Sunday, November 27, 2011

http://ChemLookup.com Compounds




CAS RN: 7369-17-7
CAS Name: 1-bromo-5H-pyrido[4,3-b]indole
OPENEYE Name: 1-bromo-5H-pyrido[4,3-b]indole
IUPAC Name: 1-bromo-5H-pyrido[4,3-b]indole
SYSTEMATIC NAME: 1-bromanyl-5H-pyrido[4,3-b]indole
MOLECULAR FORMULA: C11H7BrN2
MOLECULAR WEIGHT: 247.09068
SMILES: C1=CC=C2C(=C1)C3=C(N2)C=CN=C3Br
Structure:

CAS RN: 22059-22-9
CAS Name: N'-hydroxyethanimidamide
OPENEYE Name: N'-hydroxyacetamidine
IUPAC Name: N'-hydroxyethanimidamide
SYSTEMATIC NAME: N'-oxidanylethanimidamide
MOLECULAR FORMULA: C2H6N2O
MOLECULAR WEIGHT: 74.08184
SMILES: C/C(=N/O)/N
Structure:

CAS RN: 1857-26-7
CAS Name: 3,7-dihydroxy-9-methoxy-6-benzofuro[3,2-c][1]benzopyranone
OPENEYE Name: 3,7-dihydroxy-9-methoxy-benzofuro[3,2-c]chromen-6-one
IUPAC Name: 3,7-dihydroxy-9-methoxy-[1]benzofuro[3,2-c]chromen-6-one
SYSTEMATIC NAME: 9-methoxy-3,7-bis(oxidanyl)-[1]benzofuro[3,2-c]chromen-6-one
MOLECULAR FORMULA: C16H10O6
MOLECULAR WEIGHT: 298.247
SMILES: COC1=CC(=C2C(=C1)OC3=C2C(=O)OC4=C3C=CC(=C4)O)O
Structure:

CAS RN: 58590-56-0
CAS Name: 7,8-dichloro-1H-benzo[g]pteridine-2,4-dione
OPENEYE Name: 7,8-dichloro-1H-benzo[g]pteridine-2,4-dione
IUPAC Name: 7,8-dichloro-1H-benzo[g]pteridine-2,4-dione
SYSTEMATIC NAME: 7,8-bis(chloranyl)-1H-benzo[g]pteridine-2,4-dione
MOLECULAR FORMULA: C10H4Cl2N4O2
MOLECULAR WEIGHT: 283.07036
SMILES: C1=C2C(=CC(=C1Cl)Cl)N=C3C(=N2)C(=O)NC(=O)N3
Structure:

CAS RN: 55919-55-6
CAS Name: 6-[(2S)-1,4-dihydroxybutan-2-yl]-7-hydroxy-9-methoxy-1,2-dihydrocyclopenta[c][1]benzopyran-3,4-dione
OPENEYE Name: 7-hydroxy-6-[(1S)-3-hydroxy-1-(hydroxymethyl)propyl]-9-methoxy-1,2-dihydrocyclopenta[c]chromene-3,4-dione
IUPAC Name: 6-[(2S)-1,4-dihydroxybutan-2-yl]-7-hydroxy-9-methoxy-1,2-dihydrocyclopenta[c]chromene-3,4-dione
SYSTEMATIC NAME: 6-[(2S)-1,4-bis(oxidanyl)butan-2-yl]-9-methoxy-7-oxidanyl-1,2-dihydrocyclopenta[c]chromene-3,4-dione
MOLECULAR FORMULA: C17H18O7
MOLECULAR WEIGHT: 334.32062
SMILES: COC1=CC(=C(C2=C1C3=C(C(=O)CC3)C(=O)O2)[C@H](CCO)CO)O
Structure:

CAS RN: 83995-34-0
CAS Name: oxo-[(E)-(1-prop-2-enyl-2-pyridinylidene)methyl]ammonium
OPENEYE Name: [(E)-(1-allyl-2-pyridylidene)methyl]-oxo-ammonium
IUPAC Name: oxo-[(E)-(1-prop-2-enylpyridin-2-ylidene)methyl]azanium
SYSTEMATIC NAME: oxidanylidene-[(E)-(1-prop-2-enylpyridin-2-ylidene)methyl]azanium
MOLECULAR FORMULA: C9H11N2O+
MOLECULAR WEIGHT: 163.19644
SMILES: C=CCN\1C=CC=C/C1=C\[NH+]=O
Structure:

CAS RN: 83919-48-6
CAS Name: 3-(2-aminoethyl)-6-[(4-azido-3-nitrophenyl)hydrazo]-5-indolone
OPENEYE Name: 3-(2-aminoethyl)-6-[2-(4-azido-3-nitro-phenyl)hydrazino]indol-5-one
IUPAC Name: 3-(2-aminoethyl)-6-[2-(4-azido-3-nitrophenyl)hydrazinyl]indol-5-one
SYSTEMATIC NAME: 3-(2-azanylethyl)-6-[2-(4-azido-3-nitro-phenyl)hydrazinyl]indol-5-one
MOLECULAR FORMULA: C16H14N8O3
MOLECULAR WEIGHT: 366.33416
SMILES: C1=CC(=C(C=C1NNC2=CC3=NC=C(C3=CC2=O)CCN)[N+](=O)[O-])N=[N+]=[N-]
Structure:

CAS RN: 83916-02-3
CAS Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[3-[[(2S)-1-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopr
OPENEYE Name: (2S)-2-amino-N-[(1R)-2-[[2-[[(1S)-2-[3-[[(1S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-1-benzyl-2-oxo-ethyl]amino]propylamino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-
IUPAC Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[3-[[(2S)-1-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(2R)-1-[[2-[[(2S)-1-[3-[[(2S)-1-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]propylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylid
MOLECULAR FORMULA: C49H62N10O10
MOLECULAR WEIGHT: 951.07758
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCCN[C@@H](CC2=CC=CC=C2)C(=O)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:

CAS RN: 83916-01-2
CAS Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]hydrazo]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hy
OPENEYE Name: (2S)-2-amino-N-[(1R)-2-[[2-[[(1S)-2-[2-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]hydrazino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphen
IUPAC Name: (2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[2-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]hydrazinyl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphen
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(2R)-1-[[2-[[(2S)-1-[2-[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidany
MOLECULAR FORMULA: C46H56N10O10
MOLECULAR WEIGHT: 908.99784
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:

CAS RN: 83808-37-1
CAS Name: 5-[[(2S)-1-[[(2S)-1-[[[(2S)-1-ethyl-2-pyrrolidinyl]-oxomethyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
OPENEYE Name: 5-[[(1S)-2-[[(1S)-2-[[(2S)-1-ethylpyrrolidine-2-carbonyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
IUPAC Name: 5-[[(2S)-1-[[(2S)-1-[[(2S)-1-ethylpyrrolidine-2-carbonyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[(2S)-1-[[(2S)-1-[[(2S)-1-ethylpyrrolidin-2-yl]carbonylamino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C18H30N4O6
MOLECULAR WEIGHT: 398.454
SMILES: CCN1CCC[C@H]1C(=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCCC(=O)O
Structure:

CAS RN: 83808-35-9
CAS Name: 5-[[(2S)-1-[[(2S)-1-[[(2S)-2-(ethylamino)-1-oxopropyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
OPENEYE Name: 5-[[(1S)-2-[[(1S)-2-[[(2S)-2-(ethylamino)propanoyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
IUPAC Name: 5-[[(2S)-1-[[(2S)-1-[[(2S)-2-(ethylamino)propanoyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[(2S)-1-[[(2S)-1-[[(2S)-2-(ethylamino)propanoyl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C16H28N4O6
MOLECULAR WEIGHT: 372.41672
SMILES: CCN[C@@H](C)C(=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCCC(=O)O
Structure:

CAS RN: 83808-39-3
CAS Name: 5-oxo-5-[[(2S)-1-oxo-1-[[(2S)-1-oxo-1-[[(2S)-1-oxo-2-(propylamino)propyl]amino]propan-2-yl]amino]propan-2-yl]amino]pentanoic acid
OPENEYE Name: 5-[[(1S)-1-methyl-2-[[(1S)-1-methyl-2-oxo-2-[[(2S)-2-(propylamino)propanoyl]amino]ethyl]amino]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
IUPAC Name: 5-oxo-5-[[(2S)-1-oxo-1-[[(2S)-1-oxo-1-[[(2S)-2-(propylamino)propanoyl]amino]propan-2-yl]amino]propan-2-yl]amino]pentanoic acid
SYSTEMATIC NAME: 5-oxidanylidene-5-[[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanylidene-1-[[(2S)-2-(propylamino)propanoyl]amino]propan-2-yl]amino]propan-2-yl]amino]pentanoic acid
MOLECULAR FORMULA: C17H30N4O6
MOLECULAR WEIGHT: 386.4433
SMILES: CCCN[C@@H](C)C(=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCCC(=O)O
Structure:

CAS RN: 83538-74-3
CAS Name: [4-(4-nitroanilino)-2-phenylphenyl]carbamothioic S-acid
OPENEYE Name: [4-(4-nitroanilino)-2-phenyl-phenyl]carbamothioic S-acid
IUPAC Name: [4-(4-nitroanilino)-2-phenylphenyl]carbamothioic S-acid
SYSTEMATIC NAME: [4-[(4-nitrophenyl)amino]-2-phenyl-phenyl]carbamothioic S-acid
MOLECULAR FORMULA: C19H15N3O3S
MOLECULAR WEIGHT: 365.4057
SMILES: C1=CC=C(C=C1)C2=C(C=CC(=C2)NC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)S
Structure:

CAS RN: 83509-42-6
CAS Name: (2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
OPENEYE Name: (2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(1S,2R,3R,4S)-4-ethyl-2,3-dihydroxy-1,5-dimethyl-hexyl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
IUPAC Name: (2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
SYSTEMATIC NAME: (2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-5-ethyl-6-methyl-3,4-bis(oxidanyl)heptan-2-yl]-10,13-dimethyl-2,3-bis(oxidanyl)-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
MOLECULAR FORMULA: C29H50O5
MOLECULAR WEIGHT: 478.7043
SMILES: CC[C@H]([C@H]([C@@H]([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)O)O)C(C)C
Structure:

CAS RN: 83351-95-5
CAS Name: acetic acid [[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridinylidene]methyl]amino] ester
OPENEYE Name: [[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)-4-pyridylidene]methyl]amino] acetate
IUPAC Name: [[(E)-[2-methyl-3-oxo-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino] acetate
SYSTEMATIC NAME: [[(E)-[2-methyl-3-oxidanylidene-5-(phosphonooxymethyl)pyridin-4-ylidene]methyl]amino] ethanoate
MOLECULAR FORMULA: C10H13N2O7P
MOLECULAR WEIGHT: 304.193181
SMILES: CC1=NC=C(/C(=C\NOC(=O)C)/C1=O)COP(=O)(O)O
Structure:

CAS RN: 83201-13-2
CAS Name: 1,5-dimethyl-6H-pyrido[3,4-h]carbazol-7-ol
OPENEYE Name: 1,5-dimethyl-6H-pyrido[3,4-h]carbazol-7-ol
IUPAC Name: 1,5-dimethyl-6H-pyrido[3,4-h]carbazol-7-ol
SYSTEMATIC NAME: 1,5-dimethyl-6H-pyrido[3,4-h]carbazol-7-ol
MOLECULAR FORMULA: C17H14N2O
MOLECULAR WEIGHT: 262.30586
SMILES: CC1=C2C(=CC3=C1C=CN=C3C)C4=C(N2)C(=CC=C4)O
Structure:

CAS RN: 83181-47-9
CAS Name: (E)-3-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]ethyl]amino]-2-diazonio-1-ethoxy-3-oxo-1-propen-1-olate
OPENEYE Name: (E)-3-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3,5-diiodo-phenoxy)-3,5-diiodo-phenyl]ethyl]amino]-2-diazonio-1-ethoxy-3-oxo-prop-1-en-1-olate
IUPAC Name: (E)-3-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]ethyl]amino]-2-diazonio-1-ethoxy-3-oxoprop-1-en-1-olate
SYSTEMATIC NAME: (E)-3-[[(2S)-3-[4-[3,5-bis(iodanyl)-4-oxidanyl-phenoxy]-3,5-bis(iodanyl)phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-diazonio-1-ethoxy-3-oxidanylidene-prop-1-en-1-olate
MOLECULAR FORMULA: C20H15I4N3O7
MOLECULAR WEIGHT: 916.96688
SMILES: CCO/C(=C(\C(=O)N[C@@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O)/[N+]#N)/[O-]
Structure:

CAS RN: 83093-58-7
CAS Name: (Z)-1-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]ethyl]amino]-2-diazonio-3,3,3-trifluoro-1-propen-1-olate
OPENEYE Name: (Z)-1-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]ethyl]amino]-2-diazonio-3,3,3-trifluoro-prop-1-en-1-olate
IUPAC Name: (Z)-1-[[(1S)-1-carboxy-2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]ethyl]amino]-2-diazonio-3,3,3-trifluoroprop-1-en-1-olate
SYSTEMATIC NAME: (Z)-1-[[(2S)-3-[3,5-bis(iodanyl)-4-(3-iodanyl-4-oxidanyl-phenoxy)phenyl]-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-2-diazonio-3,3,3-tris(fluoranyl)prop-1-en-1-olate
MOLECULAR FORMULA: C18H11F3I3N3O5
MOLECULAR WEIGHT: 787.00566
SMILES: C1=CC(=C(C=C1OC2=C(C=C(C=C2I)C[C@@H](C(=O)O)N/C(=C(\C(F)(F)F)/[N+]#N)/[O-])I)I)O
Structure:

CAS RN: 83048-35-5
CAS Name: 3-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxy]-2-oxanyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyran-4-one
OPENEYE Name: 3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one
IUPAC Name: 3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-4,5-bis(oxidanyl)-3-[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-oxan-2-yl]oxy-5,7-bis(oxidanyl)chromen-4-one
MOLECULAR FORMULA: C26H28O16
MOLECULAR WEIGHT: 596.49092
SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)CO)O)O)O)O)O
Structure:

CAS RN: 82972-54-1
CAS Name: (Z,5S)-5-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]-1-diazonio-6-hydroxy-6-oxo-1-hexen-2-olate
OPENEYE Name: (Z,5S)-5-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-1-diazonio-6-hydroxy-6-oxo-hex-1-en-2-olate
IUPAC Name: (Z,5S)-5-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
SYSTEMATIC NAME: (Z,5S)-5-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]-1-diazonio-6-oxidanyl-6-oxidanylidene-hex-1-en-2-olate
MOLECULAR FORMULA: C21H22N10O4
MOLECULAR WEIGHT: 478.46398
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CC/C(=C/[N+]#N)/[O-])C(=O)O
Structure:

CAS RN: 82925-85-7
CAS Name: (5aS,6aS,7S,9Z,10aR)-9-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-5a,6,6a,7-tetrahydrobenzo[b]thioxanthene-8,10,11-trione
OPENEYE Name: (5aS,6aS,7S,9Z,10aR)-9-[amino(hydroxy)methylene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-5a,6,6a,7-tetrahydrobenzo[b]thioxanthene-8,10,11-trione
IUPAC Name: (5aS,6aS,7S,9Z,10aR)-9-[amino(hydroxy)methylidene]-4,7-bis(dimethylamino)-1,10a,12-trihydroxy-5a,6,6a,7-tetrahydrobenzo[b]thioxanthene-8,10,11-trione
SYSTEMATIC NAME: (5aS,6aS,7S,9Z,10aR)-9-[azanyl(oxidanyl)methylidene]-4,7-bis(dimethylamino)-1,10a,12-tris(oxidanyl)-5a,6,6a,7-tetrahydrobenzo[b]thioxanthene-8,10,11-trione
MOLECULAR FORMULA: C22H25N3O7S
MOLECULAR WEIGHT: 475.5148
SMILES: CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(C4=C(C=CC(=C4S3)N(C)C)O)O)C(=O)[C@@]2(C(=O)/C(=C(/N)\O)/C1=O)O
Structure:

CAS RN: 82868-96-0
CAS Name: 1,8-dihydroxy-2,3,4,6-tetramethoxy-9-xanthenone
OPENEYE Name: 1,8-dihydroxy-2,3,4,6-tetramethoxy-xanthen-9-one
IUPAC Name: 1,8-dihydroxy-2,3,4,6-tetramethoxyxanthen-9-one
SYSTEMATIC NAME: 2,3,4,6-tetramethoxy-1,8-bis(oxidanyl)xanthen-9-one
MOLECULAR FORMULA: C17H16O8
MOLECULAR WEIGHT: 348.30414
SMILES: COC1=CC(=C2C(=C1)OC3=C(C2=O)C(=C(C(=C3OC)OC)OC)O)O
Structure:

CAS RN: 82867-31-0
CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamido-1-oxopropyl]amino]-1-oxopropyl]amino]-6-amino-N-[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-nitrophenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxopropyl]hexanamide
OPENEYE Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]amino]-6-amino-N-[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]amino]propanoyl]amino]propanoyl]hexanamide
IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]amino]-6-amino-N-[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-nitrophenyl)propanoyl]amino]propanoyl]amino]propanoyl]hexanamide
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]propanoyl]amino]-6-azanyl-N-[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-(4-nitrophenyl)propanoyl]amino]propanoyl]amino]propanoyl]hexanamide
MOLECULAR FORMULA: C29H45N9O9
MOLECULAR WEIGHT: 663.7225
SMILES: C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])N)NC(=O)C
Structure:

CAS RN: 95140-42-4
CAS Name: (2R,3S,4R,5R)-hexane-1,2,3,4,5,6-hexol
OPENEYE Name: (2R,3S,4R,5R)-hexane-1,2,3,4,5,6-hexol
IUPAC Name: (2R,3S,4R,5R)-hexane-1,2,3,4,5,6-hexol
SYSTEMATIC NAME: (2R,3S,4R,5R)-hexane-1,2,3,4,5,6-hexol
MOLECULAR FORMULA: C6H14O6
MOLECULAR WEIGHT: 184.164302
SMILES: C([C@H]([C@H]([C@@H]([14C@@H](CO)O)O)O)O)O
Structure:

CAS RN: 80830-10-0
CAS Name: (4E)-4-(5,6-dihydro-3H-[1,2,4]triazolo[5,1-a]isoquinolin-2-ylidene)-2-hydroxy-1-cyclohexa-2,5-dienone
OPENEYE Name: (4E)-4-(5,6-dihydro-3H-[1,2,4]triazolo[5,1-a]isoquinolin-2-ylidene)-2-hydroxy-cyclohexa-2,5-dien-1-one
IUPAC Name: (4E)-4-(5,6-dihydro-3H-[1,2,4]triazolo[5,1-a]isoquinolin-2-ylidene)-2-hydroxycyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: (4E)-4-(5,6-dihydro-3H-[1,2,4]triazolo[5,1-a]isoquinolin-2-ylidene)-2-oxidanyl-cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C16H13N3O2
MOLECULAR WEIGHT: 279.29332
SMILES: C1CN2C(=N/C(=C\3/C=CC(=O)C(=C3)O)/N2)C4=CC=CC=C41
Structure:

CAS RN: 151013-48-8
CAS Name: (5Z)-3-amino-5-[(2E)-1-cyano-2-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-1,2-dihydropyrazole-4-carbonitrile
OPENEYE Name: (5Z)-3-amino-5-[(2E)-1-cyano-2-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1,2-dihydropyrazole-4-carbonitrile
IUPAC Name: (5Z)-3-amino-5-[(2E)-1-cyano-2-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1,2-dihydropyrazole-4-carbonitrile
SYSTEMATIC NAME: (5Z)-3-azanyl-5-[(2E)-1-cyano-2-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1,2-dihydropyrazole-4-carbonitrile
MOLECULAR FORMULA: C13H9N5O2
MOLECULAR WEIGHT: 267.24286
SMILES: C\1=CC(=O)C(=C/C1=C/C(=C/2\C(=C(NN2)N)C#N)/C#N)O
Structure:

CAS RN: 113634-10-9
CAS Name: copper N,N'-bis(2-imidazolylidenemethyl)butane-1,4-diamine diperchlorate
OPENEYE Name: copper N,N'-bis(imidazol-2-ylidenemethyl)butane-1,4-diamine diperchlorate
IUPAC Name: copper N,N'-bis(imidazol-2-ylidenemethyl)butane-1,4-diamine diperchlorate
SYSTEMATIC NAME: copper N,N'-bis(imidazol-2-ylidenemethyl)butane-1,4-diamine diperchlorate
MOLECULAR FORMULA: C12H16Cl2CuN6O8
MOLECULAR WEIGHT: 506.74284
SMILES: C1=NC(=CNCCCCNC=C2N=CC=N2)N=C1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cu+2]
Structure:

CAS RN: 113031-38-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C37H42N4O2Zn
MOLECULAR WEIGHT: 640.16398
SMILES: CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C5=C/C(=C(\[O-])/OCC)/C6(C5=NC(=CC1=N2)C6C)CC)C)CC)C(=C3CC)C)C.[Zn+2]
Structure:

CAS RN: 82355-81-5
CAS Name: (3E)-1-ethyl-3-(3-oxo-1H-indol-2-ylidene)-2-indolone
OPENEYE Name: (3E)-1-ethyl-3-(3-oxoindolin-2-ylidene)indolin-2-one
IUPAC Name: (3E)-1-ethyl-3-(3-oxo-1H-indol-2-ylidene)indol-2-one
SYSTEMATIC NAME: (3E)-1-ethyl-3-(3-oxidanylidene-1H-indol-2-ylidene)indol-2-one
MOLECULAR FORMULA: C18H14N2O2
MOLECULAR WEIGHT: 290.31596
SMILES: CCN1C2=CC=CC=C2/C(=C\3/C(=O)C4=CC=CC=C4N3)/C1=O
Structure:

CAS RN: 82221-89-4
CAS Name: (2S)-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]-2-[2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxo
OPENEYE Name: (2S)-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]-2-[2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-pr
IUPAC Name: (2S)-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]-2-[2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylprop
SYSTEMATIC NAME: (2S)-N-[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]-2-[2-[[(2S)-2-[[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-
MOLECULAR FORMULA: C60H82N12O12
MOLECULAR WEIGHT: 1163.36628
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)NCCN[C@@H](CC(C)C)C(=O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:

CAS RN: 82155-66-6
CAS Name: 4-[[(2S)-1-[[(2S)-3-(4-hydroxyphenyl)-1-[[(2S)-4-methyl-1-[[(2S)-3-methyl-2-(4-nitroanilino)-1-oxobutyl]amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
OPENEYE Name: 4-[[(1S)-2-[[(1S)-1-[(4-hydroxyphenyl)methyl]-2-[[(1S)-3-methyl-1-[[(2S)-3-methyl-2-(4-nitroanilino)butanoyl]carbamoyl]butyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]amino]-4-oxo-butanoic acid
IUPAC Name: 4-[[(2S)-1-[[(2S)-3-(4-hydroxyphenyl)-1-[[(2S)-4-methyl-1-[[(2S)-3-methyl-2-(4-nitroanilino)butanoyl]amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[[(2S)-1-[[(2S)-3-(4-hydroxyphenyl)-1-[[(2S)-4-methyl-1-[[(2S)-3-methyl-2-[(4-nitrophenyl)amino]butanoyl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C33H44N6O10
MOLECULAR WEIGHT: 684.73666
SMILES: C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC(C)C)C(=O)NC(=O)[C@H](C(C)C)NC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCC(=O)O
Structure:

CAS RN: 82084-92-2
CAS Name: N-[(2R)-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1R)-2-[[(2S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-3-phenyl-propanoyl]amino]-1-benzyl-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[(2R)-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-3-phenylpropanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2R)-1-[[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-3-phenyl-propanoyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate
MOLECULAR FORMULA: C29H40N4O5
MOLECULAR WEIGHT: 524.6517
SMILES: CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@H](CC2=CC=CC=C2)N[C@@H](CCCCN)C=O
Structure:

CAS RN: 82050-16-6
CAS Name: N-[(2S)-5-amino-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-1-oxo-3-phenylpropyl]amino]-1,5-dioxopentan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1S)-4-amino-1-[[(2S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-3-phenyl-propanoyl]carbamoyl]-4-oxo-butyl]carbamate
IUPAC Name: tert-butyl N-[(2S)-5-amino-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-3-phenylpropanoyl]amino]-1,5-dioxopentan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S)-5-azanyl-1-[[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-3-phenyl-propanoyl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]carbamate
MOLECULAR FORMULA: C25H39N5O6
MOLECULAR WEIGHT: 505.60706
SMILES: CC(C)(C)OC(=O)N[C@@H](CCC(=O)N)C(=O)NC(=O)[C@H](CC1=CC=CC=C1)N[C@@H](CCCCN)C=O
Structure:

CAS RN: 82017-64-9
CAS Name: (2S)-2-(diaminomethylideneamino)-N-[(2R)-1-[[2-[[(2S)-2-[[(2S)-1-hydroxy-4-methylsulfinylbutan-2-yl]-methylamino]-1-oxo-3-phenylpropyl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
OPENEYE Name: (2S)-2-guanidino-N-[(1R)-2-[[2-[[(2S)-2-[[(1S)-1-(hydroxymethyl)-3-methylsulfinyl-propyl]-methyl-amino]-3-phenyl-propanoyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide
IUPAC Name: (2S)-2-(diaminomethylideneamino)-N-[(2R)-1-[[2-[[(2S)-2-[[(2S)-1-hydroxy-4-methylsulfinylbutan-2-yl]-methylamino]-3-phenylpropanoyl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-[bis(azanyl)methylideneamino]-3-(4-hydroxyphenyl)-N-[(2R)-1-[[2-[[(2S)-2-[methyl-[(2S)-4-methylsulfinyl-1-oxidanyl-butan-2-yl]amino]-3-phenyl-propanoyl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]propanamide
MOLECULAR FORMULA: C30H43N7O7S
MOLECULAR WEIGHT: 645.77012
SMILES: C[C@H](C(=O)NCC(=O)NC(=O)[C@H](CC1=CC=CC=C1)N(C)[C@@H](CCS(=O)C)CO)NC(=O)[C@H](CC2=CC=C(C=C2)O)N=C(N)N
Structure:

CAS RN: 81919-18-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C46H62N4O8
MOLECULAR WEIGHT: 799.00648
SMILES: C1C[C@]2([C@H]3CC4=C5[C@@]2(CCN3CC6CC6)[C@H]([C@@H]1NCCOCCOCCN[C@@H]7CC[C@]8([C@H]9CC1=C2[C@]8([C@H]7OC2=C(C=C1)O)CCN9CC1CC1)O)OC5=C(C=C4)O)O
Structure:

CAS RN: 81910-23-8
CAS Name: (Z)-2-diazonio-1-[(2S)-5-oxo-1-phenylmethoxycarbonyl-2-pyrrolidinyl]ethenolate
OPENEYE Name: (Z)-1-[(2S)-1-benzyloxycarbonyl-5-oxo-pyrrolidin-2-yl]-2-diazonio-ethenolate
IUPAC Name: (Z)-2-diazonio-1-[(2S)-5-oxo-1-phenylmethoxycarbonylpyrrolidin-2-yl]ethenolate
SYSTEMATIC NAME: (Z)-2-diazonio-1-[(2S)-5-oxidanylidene-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]ethenolate
MOLECULAR FORMULA: C14H13N3O4
MOLECULAR WEIGHT: 287.27072
SMILES: C1CC(=O)N([C@@H]1/C(=C/[N+]#N)/[O-])C(=O)OCC2=CC=CC=C2
Structure:

CAS RN: 81849-98-1
CAS Name: 4-[[7-chloro-2-(1-pyrrolidinyl)-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl]imino]-2,6-bis(1-pyrrolidinylmethyl)-1-cyclohexa-2,5-dienone
OPENEYE Name: 4-[(7-chloro-2-pyrrolidin-1-yl-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one
IUPAC Name: 4-[(7-chloro-2-pyrrolidin-1-yl-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 4-[(7-chloranyl-2-pyrrolidin-1-yl-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C32H37ClN6O
MOLECULAR WEIGHT: 557.12878
SMILES: C1CCN(C1)CC2=CC(=NC3=C4C(=CC=C(N4)N5CCCC5)NC6=C3C=CC(=C6)Cl)C=C(C2=O)CN7CCCC7
Structure:

CAS RN: 81733-82-6
CAS Name: (2S)-2-amino-N-[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]-3-(4-nitrophenyl)propanamide
OPENEYE Name: (2S)-2-amino-N-[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]-3-(4-nitrophenyl)propanamide
IUPAC Name: (2S)-2-amino-N-[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]-3-(4-nitrophenyl)propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoyl]-3-(4-nitrophenyl)propanamide
MOLECULAR FORMULA: C23H28N6O7
MOLECULAR WEIGHT: 500.50442
SMILES: C[C@H](C(=O)NCC(=O)NC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])N)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
Structure:

CAS RN: 81655-72-3
CAS Name: (2R)-5-amino-2-[[(2S)-2-[[2-[[(2S,3R,4R,5S,6R)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)-4-oxanyl]oxy]-1-oxopropyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid
OPENEYE Name: (2R)-5-amino-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanoylamino]propanoyl]amino]-5-oxo-pentanoic acid
IUPAC Name: (2R)-5-amino-2-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-amino-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: (2R)-5-azanyl-2-[[(2S)-2-[2-[(2R,3S,4R,5R,6S)-5-azanyl-2-(hydroxymethyl)-3,6-bis(oxidanyl)oxan-4-yl]oxypropanoylamino]propanoyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C17H30N4O10
MOLECULAR WEIGHT: 450.4409
SMILES: C[C@@H](C(=O)N[C@H](CCC(=O)N)C(=O)O)NC(=O)C(C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)O)N
Structure:

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