CAS RN: 23615-79-4
CAS Name: disodium (5,7-dihydroxy-4-oxo-2-phenyl-1-benzopyran-6-yl) phosphate
OPENEYE Name: disodium (5,7-dihydroxy-4-oxo-2-phenyl-chromen-6-yl) phosphate
IUPAC Name: disodium (5,7-dihydroxy-4-oxo-2-phenylchromen-6-yl) phosphate
SYSTEMATIC NAME: disodium [5,7-bis(oxidanyl)-4-oxidanylidene-2-phenyl-chromen-6-yl] phosphate
MOLECULAR FORMULA: C15H9Na2O8P
MOLECULAR WEIGHT: 394.180461
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O)OP(=O)([O-])[O-])O.[Na+].[Na+]
Structure:
CAS RN: 19016-60-5
CAS Name: (Z)-1-diazonio-3-(2,4-dinitroanilino)-1-propen-2-olate
OPENEYE Name: (Z)-1-diazonio-3-(2,4-dinitroanilino)prop-1-en-2-olate
IUPAC Name: (Z)-1-diazonio-3-(2,4-dinitroanilino)prop-1-en-2-olate
SYSTEMATIC NAME: (Z)-1-diazonio-3-[(2,4-dinitrophenyl)amino]prop-1-en-2-olate
MOLECULAR FORMULA: C9H7N5O5
MOLECULAR WEIGHT: 265.18238
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC/C(=C/[N+]#N)/[O-]
Structure:
CAS RN: 446-21-9
CAS Name: (2R,3R)-3-hydroxy-2-tetradecyloctadecanoic acid
OPENEYE Name: (2R,3R)-3-hydroxy-2-tetradecyl-octadecanoic acid
IUPAC Name: (2R,3R)-3-hydroxy-2-tetradecyloctadecanoic acid
SYSTEMATIC NAME: (2R,3R)-3-oxidanyl-2-tetradecyl-octadecanoic acid
MOLECULAR FORMULA: C32H64O3
MOLECULAR WEIGHT: 496.84876
SMILES: CCCCCCCCCCCCCCC[C@H]([C@@H](CCCCCCCCCCCCCC)C(=O)O)O
Structure:
CAS RN: 18951-35-4
CAS Name: (2R,3R)-3-hydroxy-2-tetradecyloctadecanoic acid
OPENEYE Name: (2R,3R)-3-hydroxy-2-tetradecyl-octadecanoic acid
IUPAC Name: (2R,3R)-3-hydroxy-2-tetradecyloctadecanoic acid
SYSTEMATIC NAME: (2R,3R)-3-oxidanyl-2-tetradecyl-octadecanoic acid
MOLECULAR FORMULA: C32H64O3
MOLECULAR WEIGHT: 496.84876
SMILES: CCCCCCCCCCCCCCC[C@H]([C@@H](CCCCCCCCCCCCCC)C(=O)O)O
Structure:
CAS RN: 15196-02-8
CAS Name: (Z,3S)-1-diazonio-4-phenyl-3-(phenylmethoxycarbonylamino)-1-buten-2-olate
OPENEYE Name: (Z,3S)-3-(benzyloxycarbonylamino)-1-diazonio-4-phenyl-but-1-en-2-olate
IUPAC Name: (Z,3S)-1-diazonio-4-phenyl-3-(phenylmethoxycarbonylamino)but-1-en-2-olate
SYSTEMATIC NAME: (Z,3S)-1-diazonio-4-phenyl-3-(phenylmethoxycarbonylamino)but-1-en-2-olate
MOLECULAR FORMULA: C18H17N3O3
MOLECULAR WEIGHT: 323.34588
SMILES: C1=CC=C(C=C1)C[C@@H](/C(=C/[N+]#N)/[O-])NC(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 13433-02-8
CAS Name: (3S)-3-amino-4-[[(1S)-1-carboxyethyl]amino]-4-oxobutanoic acid
OPENEYE Name: (3S)-3-amino-4-[[(1S)-1-carboxyethyl]amino]-4-oxo-butanoic acid
IUPAC Name: (3S)-3-amino-4-[[(1S)-1-carboxyethyl]amino]-4-oxobutanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-4-oxidanylidene-4-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid
MOLECULAR FORMULA: C7H12N2O5
MOLECULAR WEIGHT: 204.18058
SMILES: C[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)O)N
Structure:
CAS RN: 188696-80-2
CAS Name: [(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]methylphosphonic acid
OPENEYE Name: [(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]methylphosphonic acid
IUPAC Name: [(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methylamino]methylphosphonic acid
SYSTEMATIC NAME: [[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methylamino]methylphosphonic acid
MOLECULAR FORMULA: C10H11N4O7P
MOLECULAR WEIGHT: 330.190701
SMILES: C1=C(C=C(C2=C1NC(=O)C(=O)N2)CNCP(=O)(O)O)[N+](=O)[O-]
Structure:
CAS RN: 147819-32-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C55H88N14O15S2
MOLECULAR WEIGHT: 1249.50202
SMILES: C[C@@H](C(=O)N[C@@H](CC12C=CC3(C(C1S2)S3)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N5CCC[C@H]5C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C=O)C(=O)N[C@@H](C)C(=O)O)N
Structure:
CAS RN: 142489-47-2
CAS Name: (2R)-2-[[(2S)-2-[[2-[2-(1,3-dioxo-2-isoindolyl)ethoxy]-1-oxoethyl]amino]-1-oxopropyl]amino]pentanedioic acid
OPENEYE Name: (2R)-2-[[(2S)-2-[[2-[2-(1,3-dioxoisoindolin-2-yl)ethoxy]acetyl]amino]propanoyl]amino]pentanedioic acid
IUPAC Name: (2R)-2-[[(2S)-2-[[2-[2-(1,3-dioxoisoindol-2-yl)ethoxy]acetyl]amino]propanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2R)-2-[[(2S)-2-[2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethoxy]ethanoylamino]propanoyl]amino]pentanedioic acid
MOLECULAR FORMULA: C20H23N3O9
MOLECULAR WEIGHT: 449.41132
SMILES: C[C@@H](C(=O)N[C@H](CCC(=O)O)C(=O)O)NC(=O)COCCN1C(=O)C2=CC=CC=C2C1=O
Structure:
CAS RN: 113981-44-5
CAS Name: (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyimino-1-oxoethyl]amino]-3-(1-imidazo[1,2-b]pyridazin-4-iumylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid chloride
OPENEYE Name: (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyimino-acetyl]amino]-3-(imidazo[1,2-b]pyridazin-4-ium-1-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid chloride
IUPAC Name: (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminoacetyl]amino]-3-(imidazo[1,2-b]pyridazin-4-ium-1-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid chloride
SYSTEMATIC NAME: (6R,7R)-7-[[(2Z)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-methoxyimino-ethanoyl]amino]-3-(imidazo[1,2-b]pyridazin-4-ium-1-ylmethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid chloride
MOLECULAR FORMULA: C19H18ClN9O5S2
MOLECULAR WEIGHT: 551.98652
SMILES: CO/N=C(/C1=NSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CN4C=C[N+]5=C4C=CC=N5)C(=O)O.[Cl-]
Structure:
CAS RN: 113799-66-9
CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-[(6-nitro-1-pyrenyl)amino]-3H-purin-6-one
OPENEYE Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-[(6-nitropyren-1-yl)amino]-3H-purin-6-one
IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-[(6-nitropyren-1-yl)amino]-3H-purin-6-one
SYSTEMATIC NAME: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-8-[(6-nitropyren-1-yl)amino]-3H-purin-6-one
MOLECULAR FORMULA: C26H21N7O6
MOLECULAR WEIGHT: 527.48824
SMILES: C1[C@@H]([C@H](O[C@H]1N2C3=C(C(=O)N=C(N3)N)N=C2NC4=C5C=CC6=C7C5=C(C=CC7=C(C=C6)[N+](=O)[O-])C=C4)CO)O
Structure:
CAS RN: 113568-92-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H10O7
MOLECULAR WEIGHT: 314.2464
SMILES: C1CC(=O)C2=C1C3=C(C=C4C(=C3OC2=O)[C@@]5(C=CO[C@@H]5O4)O)O
Structure:
CAS RN: 99508-95-9
CAS Name: 6,7-dihydroxy-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6,7-dihydro-4H-imidazo[1,2-a]purin-9-one
OPENEYE Name: 6,7-dihydroxy-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6,7-dihydro-4H-imidazo[1,2-a]purin-9-one
IUPAC Name: 6,7-dihydroxy-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,7-dihydro-4H-imidazo[1,2-a]purin-9-one
SYSTEMATIC NAME: 3-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-6,7-bis(oxidanyl)-6,7-dihydro-4H-imidazo[1,2-a]purin-9-one
MOLECULAR FORMULA: C12H15N5O6
MOLECULAR WEIGHT: 325.2774
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC4=NC(C(N4C3=O)O)O)CO)O
Structure:
CAS RN: 99224-13-2
CAS Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-benzopyran-4-one
OPENEYE Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy]chromen-4-one
IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]-3,8-bis[[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy]-5,7-bis(oxidanyl)chromen-4-one
MOLECULAR FORMULA: C27H30O18
MOLECULAR WEIGHT: 642.5163
SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O
Structure:
CAS RN: 63470-53-1
CAS Name: carbanide; gold(3+); (Z)-1,1,1-trifluoro-4-oxo-2-penten-2-olate
OPENEYE Name: carbanide; gold(3+); (Z)-1,1,1-trifluoro-4-oxo-pent-2-en-2-olate
IUPAC Name: carbanide; gold(3+); (Z)-1,1,1-trifluoro-4-oxopent-2-en-2-olate
SYSTEMATIC NAME: carbanide; gold(3+); (Z)-1,1,1-tris(fluoranyl)-4-oxidanylidene-pent-2-en-2-olate
MOLECULAR FORMULA: C7H10AuF3O2
MOLECULAR WEIGHT: 380.11486
SMILES: [CH3-].[CH3-].CC(=O)/C=C(/C(F)(F)F)\[O-].[Au+3]
Structure:
CAS RN: 62268-04-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24ClNO4
MOLECULAR WEIGHT: 377.86186
SMILES: CCC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C.Cl
Structure:
CAS RN: 67706-17-6
CAS Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid
OPENEYE Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoic acid
IUPAC Name: (2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C23H28N4O6
MOLECULAR WEIGHT: 456.49162
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
Structure:
CAS RN: 65114-55-8
CAS Name: [(2R)-2-[12-[(E)-2-diazonio-3,3,3-trifluoro-1-oxidoprop-1-enoxy]-1-oxododecoxy]-3-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-2-[12-[(E)-2-diazonio-3,3,3-trifluoro-1-oxido-prop-1-enoxy]dodecanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-2-[12-[(E)-2-diazonio-3,3,3-trifluoro-1-oxidoprop-1-enoxy]dodecanoyloxy]-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-2-[12-[(E)-2-diazonio-3,3,3-tris(fluoranyl)-1-oxidanidyl-prop-1-enoxy]dodecanoyloxy]-3-hexadecanoyloxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C39H71F3N3O10P
MOLECULAR WEIGHT: 829.964111
SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCO/C(=C(\C(F)(F)F)/[N+]#N)/[O-]
Structure:
CAS RN: 64060-84-0
CAS Name: [(2R)-2-[(1R)-1-(6-aminopurin-9-yl)-2-oxoethoxy]-3-oxopropyl] phosphono hydrogen phosphate
OPENEYE Name: [(2R)-2-[(1R)-1-(6-aminopurin-9-yl)-2-oxo-ethoxy]-3-oxo-propyl] phosphono hydrogen phosphate
IUPAC Name: [(2R)-2-[(1R)-1-(6-aminopurin-9-yl)-2-oxoethoxy]-3-oxopropyl] phosphono hydrogen phosphate
SYSTEMATIC NAME: [(2R)-2-[(1R)-1-(6-aminopurin-9-yl)-2-oxidanylidene-ethoxy]-3-oxidanylidene-propyl] phosphono hydrogen phosphate
MOLECULAR FORMULA: C10H13N5O10P2
MOLECULAR WEIGHT: 425.185242
SMILES: C1=NC2=C(C(=N1)N)N=CN2[C@@H](C=O)O[C@H](COP(=O)(O)OP(=O)(O)O)C=O
Structure:
CAS RN: 32225-99-3
CAS Name: (2S)-2-[[oxo-[4-[(4-oxo-1H-pteridin-6-yl)methylamino]phenyl]methyl]amino]pentanedioic acid
OPENEYE Name: (2S)-2-[[4-[(4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
IUPAC Name: (2S)-2-[[4-[(4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[4-[(4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid
MOLECULAR FORMULA: C19H18N6O6
MOLECULAR WEIGHT: 426.38282
SMILES: C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=CN3
Structure:
CAS RN: 26038-83-5
CAS Name: 4-heptadecyl-7-hydroxy-1-benzopyran-2-one
OPENEYE Name: 4-heptadecyl-7-hydroxy-chromen-2-one
IUPAC Name: 4-heptadecyl-7-hydroxychromen-2-one
SYSTEMATIC NAME: 4-heptadecyl-7-oxidanyl-chromen-2-one
MOLECULAR FORMULA: C26H40O3
MOLECULAR WEIGHT: 400.594
SMILES: CCCCCCCCCCCCCCCCCC1=CC(=O)OC2=C1C=CC(=C2)O
Structure:
CAS RN: 18550-55-5
CAS Name: N-hydroxynitramide
OPENEYE Name: N-hydroxynitramide
IUPAC Name: N-hydroxynitramide
SYSTEMATIC NAME: N-oxidanylnitramide
MOLECULAR FORMULA: H2N2O3
MOLECULAR WEIGHT: 78.02748
SMILES: N([N+](=O)[O-])O
Structure:
CAS RN: 2652-16-6
CAS Name: 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g][1]benzopyran-8-one
OPENEYE Name: 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
IUPAC Name: 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
SYSTEMATIC NAME: 7-(2-methoxyphenyl)-9-oxidanyl-[1,3]dioxolo[4,5-g]chromen-8-one
MOLECULAR FORMULA: C17H12O6
MOLECULAR WEIGHT: 312.27358
SMILES: COC1=CC=CC=C1C2=COC3=CC4=C(C(=C3C2=O)O)OCO4
Structure:
CAS RN: 1480-89-3
CAS Name: 6-fluoro-7H-purine
OPENEYE Name: 6-fluoro-7H-purine
IUPAC Name: 6-fluoro-7H-purine
SYSTEMATIC NAME: 6-fluoranyl-7H-purine
MOLECULAR FORMULA: C5H3FN4
MOLECULAR WEIGHT: 138.102523
SMILES: C1=NC2=C(N1)C(=NC=N2)F
Structure:
CAS RN: 78081-74-0
CAS Name: (Z,5S)-5-amino-6-(carboxymethylamino)-1-diazonio-6-oxo-1-hexen-2-olate
OPENEYE Name: (Z,5S)-5-amino-6-(carboxymethylamino)-1-diazonio-6-oxo-hex-1-en-2-olate
IUPAC Name: (Z,5S)-5-amino-6-(carboxymethylamino)-1-diazonio-6-oxohex-1-en-2-olate
SYSTEMATIC NAME: (Z,5S)-5-azanyl-1-diazonio-6-(2-hydroxy-2-oxoethylamino)-6-oxidanylidene-hex-1-en-2-olate
MOLECULAR FORMULA: C8H12N4O4
MOLECULAR WEIGHT: 228.20528
SMILES: C(C/C(=C/[N+]#N)/[O-])[C@@H](C(=O)NCC(=O)O)N
Structure:
CAS RN: 75590-17-9
CAS Name: (2R)-2-amino-N-[(2S)-2-[[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]amino]-1-oxo-3-phenylpropyl]-3-methylbutanamide
OPENEYE Name: (2R)-2-amino-N-[(2S)-2-[[(1S)-5-amino-1-(2-chloroacetyl)pentyl]amino]-3-phenyl-propanoyl]-3-methyl-butanamide
IUPAC Name: (2R)-2-amino-N-[(2S)-2-[[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]amino]-3-phenylpropanoyl]-3-methylbutanamide
SYSTEMATIC NAME: (2R)-2-azanyl-N-[(2S)-2-[[(3S)-7-azanyl-1-chloranyl-2-oxidanylidene-heptan-3-yl]amino]-3-phenyl-propanoyl]-3-methyl-butanamide
MOLECULAR FORMULA: C21H33ClN4O3
MOLECULAR WEIGHT: 424.96472
SMILES: CC(C)[C@H](C(=O)NC(=O)[C@H](CC1=CC=CC=C1)N[C@@H](CCCCN)C(=O)CCl)N
Structure:
CAS RN: 158365-17-4
CAS Name: (1E)-9-methyl-3,6-dihydro-2H-pyrido[4,3-f][1,4]oxazocine-4,10-dione
OPENEYE Name: (1E)-9-methyl-3,6-dihydro-2H-pyrido[4,3-f][1,4]oxazocine-4,10-dione
IUPAC Name: (1E)-9-methyl-3,6-dihydro-2H-pyrido[4,3-f][1,4]oxazocine-4,10-dione
SYSTEMATIC NAME: (1E)-9-methyl-3,6-dihydro-2H-pyrido[4,3-f][1,4]oxazocine-4,10-dione
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: CC1=NC=C/2COC(=O)CN/C=C2/C1=O
Structure:
CAS RN: 65115-01-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H27NO2
MOLECULAR WEIGHT: 301.42318
SMILES: COC1=CCC2C[C@H]3[C@H]4C=CCC[C@]4(C2=C1)CCN3CCO
Structure:
CAS RN: 72746-38-4
CAS Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(E)-2,3,4,5-tetrahydroxy-6-[(E)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]-1-benzopyran-4-one
OPENEYE Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(E)-2,3,4,5-tetrahydroxy-6-[(E)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]chromen-4-one
IUPAC Name: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(E)-2,3,4,5-tetrahydroxy-6-[(E)-2,3,4,5,6-pentahydroxyhex-3-enoxy]hex-3-enoxy]chromen-4-one
SYSTEMATIC NAME: 2-[3,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)-3-[(E)-2,3,4,5-tetrakis(oxidanyl)-6-[(E)-2,3,4,5,6-pentakis(oxidanyl)hex-3-enoxy]hex-3-enoxy]chromen-4-one
MOLECULAR FORMULA: C27H30O17
MOLECULAR WEIGHT: 626.5169
SMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OCC(/C(=C(/C(COCC(/C(=C(/C(CO)O)\O)/O)O)O)\O)/O)O)O)O
Structure:
CAS RN: 75919-70-9
CAS Name: (2R,3S,4S,5R,6S,7R)-6-amino-2,3,4,5-tetrahydroxy-7-methoxyoctanal
OPENEYE Name: (2R,3S,4S,5R,6S,7R)-6-amino-2,3,4,5-tetrahydroxy-7-methoxy-octanal
IUPAC Name: (2R,3S,4S,5R,6S,7R)-6-amino-2,3,4,5-tetrahydroxy-7-methoxyoctanal
SYSTEMATIC NAME: (2R,3S,4S,5R,6S,7R)-6-azanyl-7-methoxy-2,3,4,5-tetrakis(oxidanyl)octanal
MOLECULAR FORMULA: C9H19NO6
MOLECULAR WEIGHT: 237.25026
SMILES: C[C@H]([C@H]([C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O)N)OC
Structure:
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