CAS RN: 119261-58-4
CAS Name: 2-[[4-[(1R,2R)-2-[(E)-2-(2-naphthalenyl)ethenyl]cyclopropyl]-1-oxobutyl]amino]benzoic acid methyl ester
OPENEYE Name: methyl 2-[4-[(1R,2R)-2-[(E)-2-(2-naphthyl)vinyl]cyclopropyl]butanoylamino]benzoate
IUPAC Name: methyl 2-[4-[(1R,2R)-2-[(E)-2-naphthalen-2-ylethenyl]cyclopropyl]butanoylamino]benzoate
SYSTEMATIC NAME: methyl 2-[4-[(1R,2R)-2-[(E)-2-naphthalen-2-ylethenyl]cyclopropyl]butanoylamino]benzoate
MOLECULAR FORMULA: C27H27NO3
MOLECULAR WEIGHT: 413.50818
SMILES: COC(=O)C1=CC=CC=C1NC(=O)CCC[C@@H]2C[C@H]2/C=C/C3=CC4=CC=CC=C4C=C3
Structure:
CAS RN: 119087-46-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C48H78O5
MOLECULAR WEIGHT: 735.12992
SMILES: CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)OC(CCC(C)(C)O)C(C)C1CCC2C1(CCC3C2=CCC4C3(CC5C(C4)OC(O5)(C)C)C)C
Structure:
CAS RN: 119052-95-8
CAS Name: 2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
OPENEYE Name: 2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
IUPAC Name: 2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
SYSTEMATIC NAME: 2-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]-3-(trifluoromethyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C31H43F3O2
MOLECULAR WEIGHT: 504.66713
SMILES: C[C@@H](CCC[C@@H](C)CCC/C(=C/CC1=C(C(=O)C2=CC=CC=C2C1=O)C(F)(F)F)/C)CCCC(C)C
Structure:
CAS RN: 118498-93-4
CAS Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,4-dihydroxy-5,5-dimethyl-3-(1-oxo-2-phenylethoxy)-6-[(1E,3E)-penta-1,3-dienyl]-2-oxanyl]-3-[[5-[(5-hydroxy-4-methoxy-6-methyl-2-oxanyl)oxy]-4-methoxy-6-methyl-2-oxanyl]oxy]-1-oxopropyl]amino]-3-methoxy-4-methylocta-4,6-di
OPENEYE Name: (2E,4E,6E)-7-[5-[(3E,5E)-7-[[2-[2,4-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylacetyl)oxy-tetrahydropyran-2-yl]-3-[5-(5-hydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-propanoyl]amino]-2-
IUPAC Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,4-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylacetyl)oxyoxan-2-yl]-3-[5-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxypropanoyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-3
SYSTEMATIC NAME: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[5,5-dimethyl-2,4-bis(oxidanyl)-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylethanoyloxy)oxan-2-yl]-3-[4-methoxy-5-(4-methoxy-6-methyl-5-oxidanyl-oxan-2-yl)oxy-6-methyl-oxan-2-yl]oxy-propanoyl]amino]-3-methoxy-4-methyl-octa-4,6-d
MOLECULAR FORMULA: C58H83NO18
MOLECULAR WEIGHT: 1082.27552
SMILES: C/C=C/C=C/C1C(C(C(C(O1)(C(COC2CC(C(C(O2)C)OC3CC(C(C(O3)C)O)OC)OC)C(=O)NC/C=C/C=C(\C)/C(C(C)C4CC(C(O4)/C=C/C=C/C=C/C(=O)O)O)OC)O)OC(=O)CC5=CC=CC=C5)O)(C)C
Structure:
CAS RN: 118498-92-3
CAS Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,3-dihydroxy-5,5-dimethyl-4-(1-oxo-2-phenylethoxy)-6-[(1E,3E)-penta-1,3-dienyl]-2-oxanyl]-3-[(3-hydroxy-6-methoxy-2-methyl-4-oxanyl)oxy]-1-oxopropyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-3-hydroxy-2-oxolanyl]hepta-2
OPENEYE Name: (2E,4E,6E)-7-[5-[(3E,5E)-7-[[2-[2,3-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-4-(2-phenylacetyl)oxy-tetrahydropyran-2-yl]-3-(3-hydroxy-6-methoxy-2-methyl-tetrahydropyran-4-yl)oxy-propanoyl]amino]-2-methoxy-1,3-dimethyl-hepta-3,5-dienyl]-3-hydrox
IUPAC Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,3-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-4-(2-phenylacetyl)oxyoxan-2-yl]-3-(3-hydroxy-6-methoxy-2-methyloxan-4-yl)oxypropanoyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-3-hydroxyoxolan-2-yl]hepta-2,4,6-tri
SYSTEMATIC NAME: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[5,5-dimethyl-2,3-bis(oxidanyl)-6-[(1E,3E)-penta-1,3-dienyl]-4-(2-phenylethanoyloxy)oxan-2-yl]-3-(6-methoxy-2-methyl-3-oxidanyl-oxan-4-yl)oxy-propanoyl]amino]-3-methoxy-4-methyl-octa-4,6-dien-2-yl]-3-oxidanyl-oxolan-2-yl]hep
MOLECULAR FORMULA: C51H71NO15
MOLECULAR WEIGHT: 938.10714
SMILES: C/C=C/C=C/C1C(C(C(C(O1)(C(COC2CC(OC(C2O)C)OC)C(=O)NC/C=C/C=C(\C)/C(C(C)C3CC(C(O3)/C=C/C=C/C=C/C(=O)O)O)OC)O)O)OC(=O)CC4=CC=CC=C4)(C)C
Structure:
CAS RN: 118498-91-2
CAS Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,4-dihydroxy-5,5-dimethyl-3-(1-oxo-2-phenylethoxy)-6-[(1E,3E)-penta-1,3-dienyl]-2-oxanyl]-3-[(3-hydroxy-6-methoxy-2-methyl-4-oxanyl)oxy]-1-oxopropyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-3-hydroxy-2-oxolanyl]hepta-2
OPENEYE Name: (2E,4E,6E)-7-[5-[(3E,5E)-7-[[2-[2,4-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylacetyl)oxy-tetrahydropyran-2-yl]-3-(3-hydroxy-6-methoxy-2-methyl-tetrahydropyran-4-yl)oxy-propanoyl]amino]-2-methoxy-1,3-dimethyl-hepta-3,5-dienyl]-3-hydrox
IUPAC Name: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[2,4-dihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylacetyl)oxyoxan-2-yl]-3-(3-hydroxy-6-methoxy-2-methyloxan-4-yl)oxypropanoyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-3-hydroxyoxolan-2-yl]hepta-2,4,6-tri
SYSTEMATIC NAME: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[5,5-dimethyl-2,4-bis(oxidanyl)-6-[(1E,3E)-penta-1,3-dienyl]-3-(2-phenylethanoyloxy)oxan-2-yl]-3-(6-methoxy-2-methyl-3-oxidanyl-oxan-4-yl)oxy-propanoyl]amino]-3-methoxy-4-methyl-octa-4,6-dien-2-yl]-3-oxidanyl-oxolan-2-yl]hep
MOLECULAR FORMULA: C51H71NO15
MOLECULAR WEIGHT: 938.10714
SMILES: C/C=C/C=C/C1C(C(C(C(O1)(C(COC2CC(OC(C2O)C)OC)C(=O)NC/C=C/C=C(\C)/C(C(C)C3CC(C(O3)/C=C/C=C/C=C/C(=O)O)O)OC)O)OC(=O)CC4=CC=CC=C4)O)(C)C
Structure:
CAS RN: 118498-90-1
CAS Name: (2E,4E,6E)-7-[3-hydroxy-5-[(4E,6E)-8-[[3-[(3-hydroxy-6-methoxy-2-methyl-4-oxanyl)oxy]-1-oxo-2-[2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]-2-oxanyl]propyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]-2-oxolanyl]hepta-2,4,6-trienoic acid
OPENEYE Name: (2E,4E,6E)-7-[3-hydroxy-5-[(3E,5E)-7-[[3-(3-hydroxy-6-methoxy-2-methyl-tetrahydropyran-4-yl)oxy-2-[2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]tetrahydropyran-2-yl]propanoyl]amino]-2-methoxy-1,3-dimethyl-hepta-3,5-dienyl]tetrahydrofuran-2-yl
IUPAC Name: (2E,4E,6E)-7-[3-hydroxy-5-[(4E,6E)-8-[[3-(3-hydroxy-6-methoxy-2-methyloxan-4-yl)oxy-2-[2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]propanoyl]amino]-3-methoxy-4-methylocta-4,6-dien-2-yl]oxolan-2-yl]hepta-2,4,6-trienoic acid
SYSTEMATIC NAME: (2E,4E,6E)-7-[5-[(4E,6E)-8-[[2-[5,5-dimethyl-2,3,4-tris(oxidanyl)-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]-3-(6-methoxy-2-methyl-3-oxidanyl-oxan-4-yl)oxy-propanoyl]amino]-3-methoxy-4-methyl-octa-4,6-dien-2-yl]-3-oxidanyl-oxolan-2-yl]hepta-2,4,6-trienoic aci
MOLECULAR FORMULA: C43H65NO14
MOLECULAR WEIGHT: 819.9745
SMILES: C/C=C/C=C/C1C(C(C(C(O1)(C(COC2CC(OC(C2O)C)OC)C(=O)NC/C=C/C=C(\C)/C(C(C)C3CC(C(O3)/C=C/C=C/C=C/C(=O)O)O)OC)O)O)O)(C)C
Structure:
CAS RN: 118106-53-9
CAS Name: (E,2R)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]-2-hydroxy-3-octadecenamide
OPENEYE Name: (E,2R)-2-hydroxy-N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)heptadecyl]octadec-3-enamide
IUPAC Name: (E,2R)-N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]-2-hydroxyoctadec-3-enamide
SYSTEMATIC NAME: (E,2R)-N-[(2S,3R)-1,3-bis(oxidanyl)octadecan-2-yl]-2-oxidanyl-octadec-3-enamide
MOLECULAR FORMULA: C36H71NO4
MOLECULAR WEIGHT: 581.95324
SMILES: CCCCCCCCCCCCCCC[C@H]([C@H](CO)NC(=O)[C@@H](/C=C/CCCCCCCCCCCCCC)O)O
Structure:
CAS RN: 118068-34-1
CAS Name: 1-[(2R,3R,5S)-3-hydroxy-5-[[(E)-2-iodoethenoxy]methyl]-2-oxolanyl]-3-methylpyrimidine-2,4-dione
OPENEYE Name: 1-[(2R,3R,5S)-3-hydroxy-5-[[(E)-2-iodovinyloxy]methyl]tetrahydrofuran-2-yl]-3-methyl-pyrimidine-2,4-dione
IUPAC Name: 1-[(2R,3R,5S)-3-hydroxy-5-[[(E)-2-iodoethenoxy]methyl]oxolan-2-yl]-3-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(2R,3R,5S)-5-[[(E)-2-iodanylethenoxy]methyl]-3-oxidanyl-oxolan-2-yl]-3-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C12H15IN2O5
MOLECULAR WEIGHT: 394.16237
SMILES: CN1C(=O)C=CN(C1=O)[C@H]2[C@@H](C[C@H](O2)CO/C=C/I)O
Structure:
CAS RN: 117591-28-3
CAS Name: [[(2R,3S,4S,5R)-5-[5-[(E)-2-(4-azidophenyl)ethenyl]-2,4-dioxo-1-pyrimidinyl]-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
OPENEYE Name: [[(2R,3S,4S,5R)-5-[5-[(E)-2-(4-azidophenyl)vinyl]-2,4-dioxo-pyrimidin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
IUPAC Name: [[(2R,3S,4S,5R)-5-[5-[(E)-2-(4-azidophenyl)ethenyl]-2,4-dioxopyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
SYSTEMATIC NAME: [[(2R,3S,4S,5R)-5-[5-[(E)-2-(4-azidophenyl)ethenyl]-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate
MOLECULAR FORMULA: C17H20N5O15P3
MOLECULAR WEIGHT: 627.286483
SMILES: C1=CC(=CC=C1/C=C/C2=CN(C(=O)NC2=O)[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N=[N+]=[N-]
Structure:
CAS RN: 117412-41-6
CAS Name: acetic acid [2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenyl] ester; platinum(2+); tetraethylammonium; tribromide
OPENEYE Name: [2-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]phenyl] acetate; platinum(2+); tetraethylammonium; tribromide
IUPAC Name: [2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenyl] acetate; platinum(2+); tetraethylazanium; tribromide
SYSTEMATIC NAME: [2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenyl] ethanoate; platinum(2+); tetraethylazanium; tribromide
MOLECULAR FORMULA: C25H33Br3N2O2PtS
MOLECULAR WEIGHT: 860.39672
SMILES: CC[N+](CC)(CC)CC.CC(=O)OC1=CC=CC=C1/C=C/C2=NC3=CC=CC=C3S2.[Br-].[Br-].[Br-].[Pt+2]
Structure:
CAS RN: 116963-87-2
CAS Name: (Z,6R)-6-[(3R,3aR,6S,7S,9bR)-6-(3-methoxy-3-oxopropyl)-3a,9b-dimethyl-7-(1-methylethenyl)-2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-2-methyl-2-heptenoic acid
OPENEYE Name: (Z,6R)-6-[(3R,3aR,6S,7S,9bR)-7-isopropenyl-6-(3-methoxy-3-oxo-propyl)-3a,9b-dimethyl-2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-2-methyl-hept-2-enoic acid
IUPAC Name: (Z,6R)-6-[(3R,3aR,6S,7S,9bR)-6-(3-methoxy-3-oxopropyl)-3a,9b-dimethyl-7-prop-1-en-2-yl-2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-2-methylhept-2-enoic acid
SYSTEMATIC NAME: (Z,6R)-6-[(3R,3aR,6S,7S,9bR)-6-(3-methoxy-3-oxidanylidene-propyl)-3a,9b-dimethyl-7-prop-1-en-2-yl-2,3,4,5,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-3-yl]-2-methyl-hept-2-enoic acid
MOLECULAR FORMULA: C30H46O4
MOLECULAR WEIGHT: 470.68384
SMILES: C[C@H](CC/C=C(/C)\C(=O)O)[C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@@H]([C@@H]3CCC(=O)OC)C(=C)C)C)C
Structure:
CAS RN: 116375-28-1
CAS Name: (2S)-2-[[2-[[(2S)-2-[[(Z,2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-1-oxohexyl]amino]-5-amino-1-oxopentyl]amino]-3-(4H-imidazol-4-yl)-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]amino]-1,5-dioxopent-3-enyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-
OPENEYE Name: (2S)-2-[[2-[[(2S)-2-[[(Z,2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamidohexanoyl]amino]-5-amino-pentanoyl]amino]-3-(4H-imidazol-4-yl)propanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxo-pent-3-enoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-6-
IUPAC Name: (2S)-2-[[2-[[(2S)-2-[[(Z,2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamidohexanoyl]amino]-5-aminopentanoyl]amino]-3-(4H-imidazol-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopent-3-enoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]-6-ami
SYSTEMATIC NAME: (2S)-2-[2-[[(2S)-2-[[(Z,2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamidohexanoyl]amino]-5-azanyl-pentanoyl]amino]-3-(4H-imidazol-4-yl)propanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxidanylidene-pent-3-enoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]ethano
MOLECULAR FORMULA: C52H72N14O10
MOLECULAR WEIGHT: 1053.21588
SMILES: CCCC[C@@H](C(=O)N[C@H](CCCN)C(=O)N[C@@H](CC1C=NC=N1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](/C=C\C=O)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)C
Structure:
CAS RN: 115178-89-7
CAS Name: (5E,8E,11E,14E)-20,20,20-trifluoroeicosa-5,8,11,14-tetraenoic acid
OPENEYE Name: (5E,8E,11E,14E)-20,20,20-trifluoroicosa-5,8,11,14-tetraenoic acid
IUPAC Name: (5E,8E,11E,14E)-20,20,20-trifluoroicosa-5,8,11,14-tetraenoic acid
SYSTEMATIC NAME: (5E,8E,11E,14E)-20,20,20-tris(fluoranyl)icosa-5,8,11,14-tetraenoic acid
MOLECULAR FORMULA: C20H29F3O2
MOLECULAR WEIGHT: 358.43827
SMILES: C(CCC(F)(F)F)C/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)O
Structure:
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