CAS RN: 89015-96-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H28O5
MOLECULAR WEIGHT: 360.44402
SMILES: CC1=CC2C(CC1)(C3(C(CC(C34CO4)O2)O)C)COC(=O)/C=C(/C)\C=C
Structure:
CAS RN: 88969-03-3
CAS Name: (E)-5-(2-dimethoxyphosphoryl-1-oxoethoxy)-3-methyl-2-pentenoic acid 2,2,2-trichloroethyl ester
OPENEYE Name: 2,2,2-trichloroethyl (E)-5-(2-dimethoxyphosphorylacetyl)oxy-3-methyl-pent-2-enoate
IUPAC Name: 2,2,2-trichloroethyl (E)-5-(2-dimethoxyphosphorylacetyl)oxy-3-methylpent-2-enoate
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethyl (E)-5-(2-dimethoxyphosphorylethanoyloxy)-3-methyl-pent-2-enoate
MOLECULAR FORMULA: C12H18Cl3O7P
MOLECULAR WEIGHT: 411.599881
SMILES: C/C(=C\C(=O)OCC(Cl)(Cl)Cl)/CCOC(=O)CP(=O)(OC)OC
Structure:
CAS RN: 88969-00-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H38O9
MOLECULAR WEIGHT: 530.60662
SMILES: CCOC(=O)/C=C/C=C/C(=O)OCC/C(=C/C(=O)OCC12CCC(=CC1OC3CC(C2(C34CO4)C)O)C)/C
Structure:
CAS RN: 88968-99-4
CAS Name: (2Z,4E)-3-(4-methoxyphenyl)-2-trimethylsilylhexa-2,4-dienedioic acid O1-ethyl ester O6-methyl ester
OPENEYE Name: O1-ethyl O6-methyl (2Z,4E)-3-(4-methoxyphenyl)-2-trimethylsilyl-hexa-2,4-dienedioate
IUPAC Name: 1-O-ethyl 6-O-methyl (2Z,4E)-3-(4-methoxyphenyl)-2-trimethylsilylhexa-2,4-dienedioate
SYSTEMATIC NAME: O1-ethyl O6-methyl (2Z,4E)-3-(4-methoxyphenyl)-2-trimethylsilyl-hexa-2,4-dienedioate
MOLECULAR FORMULA: C19H26O5Si
MOLECULAR WEIGHT: 362.49224
SMILES: CCOC(=O)/C(=C(\C=C\C(=O)OC)/C1=CC=C(C=C1)OC)/[Si](C)(C)C
Structure:
CAS RN: 88968-96-1
CAS Name: (E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methyl-2-pentenoic acid
OPENEYE Name: (E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methyl-pent-2-enoic acid
IUPAC Name: (E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-2-enoic acid
SYSTEMATIC NAME: (E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methyl-pent-2-enoic acid
MOLECULAR FORMULA: C12H24O3Si
MOLECULAR WEIGHT: 244.40266
SMILES: C/C(=C\C(=O)O)/CCO[Si](C)(C)C(C)(C)C
Structure:
CAS RN: 88968-94-9
CAS Name: (E)-5-(2-dimethoxyphosphoryl-1-oxoethoxy)-3-methyl-2-pentenoic acid
OPENEYE Name: (E)-5-(2-dimethoxyphosphorylacetyl)oxy-3-methyl-pent-2-enoic acid
IUPAC Name: (E)-5-(2-dimethoxyphosphorylacetyl)oxy-3-methylpent-2-enoic acid
SYSTEMATIC NAME: (E)-5-(2-dimethoxyphosphorylethanoyloxy)-3-methyl-pent-2-enoic acid
MOLECULAR FORMULA: C10H17O7P
MOLECULAR WEIGHT: 280.211541
SMILES: C/C(=C\C(=O)O)/CCOC(=O)CP(=O)(OC)OC
Structure:
CAS RN: 88587-97-7
CAS Name: (5Z,8Z,11Z,14Z)-eicosa-5,8,11,14-tetraenoic acid [(2R)-1-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-(1-oxohexadecoxy)propan-2-yl] ester
OPENEYE Name: [(1R)-1-(hexadecanoyloxymethyl)-2-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexoxy]phosphoryl]oxy-ethyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
IUPAC Name: [(2R)-1-hexadecanoyloxy-3-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
SYSTEMATIC NAME: [(2R)-1-hexadecanoyloxy-3-[oxidanyl-[(2S,3S,5R,6S)-2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
MOLECULAR FORMULA: C45H79O13P
MOLECULAR WEIGHT: 859.074721
SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1[C@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
Structure:
CAS RN: 88587-96-6
CAS Name: octadecanoic acid [(2R)-3-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]propyl] ester
OPENEYE Name: [(2R)-3-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexoxy]phosphoryl]oxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-propyl] octadecanoate
IUPAC Name: [(2R)-3-[hydroxy-[(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] octadecanoate
SYSTEMATIC NAME: [(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[oxidanyl-[(2S,3S,5R,6S)-2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] octadecanoate
MOLECULAR FORMULA: C45H83O13P
MOLECULAR WEIGHT: 863.106481
SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1[C@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Structure:
CAS RN: 88542-98-7
CAS Name: [(2R)-3-[(E)-octadec-9-enoxy]-2-[(5E,8E,11E,14E)-1-oxoeicosa-5,8,11,14-tetraenoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-2-[(5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoyl]oxy-3-[(E)-octadec-9-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-2-[(5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoyl]oxy-3-[(E)-octadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-2-[(5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoyl]oxy-3-[(E)-octadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C46H84NO7P
MOLECULAR WEIGHT: 794.135421
SMILES: CCCCCCCC/C=C/CCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC
Structure:
CAS RN: 88542-97-6
CAS Name: [(2R)-3-[(Z)-octadec-9-enoxy]-2-[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(Z)-octadec-9-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(Z)-octadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(Z)-octadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C44H84NO7P
MOLECULAR WEIGHT: 770.114021
SMILES: CCCCCCCC/C=C\CCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Structure:
CAS RN: 88542-95-4
CAS Name: [(2R)-3-hexadecoxy-2-[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-3-hexadecoxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-3-hexadecoxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-3-hexadecoxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C42H82NO7P
MOLECULAR WEIGHT: 744.076741
SMILES: CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Structure:
CAS RN: 88542-94-3
CAS Name: [(2R)-3-[(Z)-hexadec-9-enoxy]-2-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-2-hexadecanoyloxy-3-[(Z)-hexadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C40H80NO7P
MOLECULAR WEIGHT: 718.039461
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCC/C=C\CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
Structure:
CAS RN: 87776-98-5
CAS Name: (E)-7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-2-heptenal
OPENEYE Name: (E)-7-(3-acetyloxazolidin-2-yl)-2,6-dimethyl-hept-2-enal
IUPAC Name: (E)-7-(3-acetyl-1,3-oxazolidin-2-yl)-2,6-dimethylhept-2-enal
SYSTEMATIC NAME: (E)-7-(3-ethanoyl-1,3-oxazolidin-2-yl)-2,6-dimethyl-hept-2-enal
MOLECULAR FORMULA: C14H23NO3
MOLECULAR WEIGHT: 253.33732
SMILES: CC(CC/C=C(\C)/C=O)CC1N(CCO1)C(=O)C
Structure:
CAS RN: 87758-52-9
CAS Name: (E,2S,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(2S)-3-oxopentan-2-yl]-2-oxanyl]-4,6-dimethyl-6-nonen-3-one
OPENEYE Name: (E,2S,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(1S)-1-methyl-2-oxo-butyl]tetrahydropyran-2-yl]-4,6-dimethyl-non-6-en-3-one
IUPAC Name: (E,2S,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(2S)-3-oxopentan-2-yl]oxan-2-yl]-4,6-dimethylnon-6-en-3-one
SYSTEMATIC NAME: (E,2S,4R)-2-[(2S,3S,4S,5R)-3,5-dimethyl-2,4-bis(oxidanyl)-6-[(2S)-3-oxidanylidenepentan-2-yl]oxan-2-yl]-4,6-dimethyl-non-6-en-3-one
MOLECULAR FORMULA: C23H40O5
MOLECULAR WEIGHT: 396.5607
SMILES: CC/C=C(\C)/C[C@@H](C)C(=O)[C@H](C)[C@@]1([C@H]([C@H]([C@H](C(O1)[C@H](C)C(=O)CC)C)O)C)O
Structure:
CAS RN: 87729-23-5
CAS Name: (2E,4Z)-6-oxo-6-(2-trimethylsilylethoxy)hexa-2,4-dienoic acid
OPENEYE Name: (2E,4Z)-6-oxo-6-(2-trimethylsilylethoxy)hexa-2,4-dienoic acid
IUPAC Name: (2E,4Z)-6-oxo-6-(2-trimethylsilylethoxy)hexa-2,4-dienoic acid
SYSTEMATIC NAME: (2E,4Z)-6-oxidanylidene-6-(2-trimethylsilylethoxy)hexa-2,4-dienoic acid
MOLECULAR FORMULA: C11H18O4Si
MOLECULAR WEIGHT: 242.34372
SMILES: C[Si](C)(C)CCOC(=O)/C=C\C=C\C(=O)O
Structure:
CAS RN: 87697-98-1
CAS Name: (E,2R,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(2S)-3-oxopentan-2-yl]-2-oxanyl]-4,6-dimethyl-6-nonen-3-one
OPENEYE Name: (E,2R,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(1S)-1-methyl-2-oxo-butyl]tetrahydropyran-2-yl]-4,6-dimethyl-non-6-en-3-one
IUPAC Name: (E,2R,4R)-2-[(2S,3S,4S,5R)-2,4-dihydroxy-3,5-dimethyl-6-[(2S)-3-oxopentan-2-yl]oxan-2-yl]-4,6-dimethylnon-6-en-3-one
SYSTEMATIC NAME: (E,2R,4R)-2-[(2S,3S,4S,5R)-3,5-dimethyl-2,4-bis(oxidanyl)-6-[(2S)-3-oxidanylidenepentan-2-yl]oxan-2-yl]-4,6-dimethyl-non-6-en-3-one
MOLECULAR FORMULA: C23H40O5
MOLECULAR WEIGHT: 396.5607
SMILES: CC/C=C(\C)/C[C@@H](C)C(=O)[C@@H](C)[C@@]1([C@H]([C@H]([C@H](C(O1)[C@H](C)C(=O)CC)C)O)C)O
Structure:
CAS RN: 87016-79-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H38O7
MOLECULAR WEIGHT: 474.58642
SMILES: C/C=C(\C)/C(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3)C)OC(=O)C)CO)C4C1(C4(C)C)O)O)C
Structure:
CAS RN: 87016-77-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H40O8
MOLECULAR WEIGHT: 516.6231
SMILES: CCCC(=O)O[C@]12CC(=C[C@H]3[C@H]4[C@](C4(C)C)([C@@H]([C@H]([C@@]3([C@@H]1C=C(C2=O)C)O)C)OC(=O)/C(=C/C)/C)O)CO
Structure:
CAS RN: 87000-09-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H66O9
MOLECULAR WEIGHT: 751.00014
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC1=C[C@H]2[C@H]3[C@](C3(C)C)([C@@H]([C@H]([C@@]2([C@@H]4C=C(C(=O)[C@]4(C1)OC(=O)C)C)O)C)OC(=O)/C(=C/C)/C)O
Structure:
CAS RN: 87000-08-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H36O8
MOLECULAR WEIGHT: 488.56994
SMILES: C/C=C(\C)/C(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)OC(=O)C)CO)[C@H]4[C@@]1(C4(C)C)O)O)C
Structure:
CAS RN: 86944-45-8
CAS Name: N-[6-[(Z)-2-bromo-1-ethoxyethenyl]-4-oxo-1H-pyrimidin-2-yl]acetamide
OPENEYE Name: N-[6-[(Z)-2-bromo-1-ethoxy-vinyl]-4-oxo-1H-pyrimidin-2-yl]acetamide
IUPAC Name: N-[6-[(Z)-2-bromo-1-ethoxyethenyl]-4-oxo-1H-pyrimidin-2-yl]acetamide
SYSTEMATIC NAME: N-[6-[(Z)-2-bromanyl-1-ethoxy-ethenyl]-4-oxidanylidene-1H-pyrimidin-2-yl]ethanamide
MOLECULAR FORMULA: C10H12BrN3O3
MOLECULAR WEIGHT: 302.12458
SMILES: CCO/C(=C\Br)/C1=CC(=O)N=C(N1)NC(=O)C
Structure:
CAS RN: 86944-16-3
CAS Name: 2-[5-bromo-2-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-1H-pyrimidin-6-yl]acetic acid [(E)-4,4-dimethoxy-3-methylbut-2-enyl] ester
OPENEYE Name: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[5-bromo-2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
IUPAC Name: [(E)-4,4-dimethoxy-3-methylbut-2-enyl] 2-[5-bromo-2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
SYSTEMATIC NAME: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[5-bromanyl-2-(2,2-dimethylpropanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate
MOLECULAR FORMULA: C18H26BrN3O6
MOLECULAR WEIGHT: 460.31954
SMILES: C/C(=C\COC(=O)CC1=C(C(=O)N=C(N1)NC(=O)C(C)(C)C)Br)/C(OC)OC
Structure:
CAS RN: 86944-15-2
CAS Name: 2-bromo-2-[5-bromo-2-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-1H-pyrimidin-6-yl]acetic acid [(E)-4,4-dimethoxy-3-methylbut-2-enyl] ester
OPENEYE Name: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-bromo-2-[5-bromo-2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
IUPAC Name: [(E)-4,4-dimethoxy-3-methylbut-2-enyl] 2-bromo-2-[5-bromo-2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
SYSTEMATIC NAME: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-bromanyl-2-[5-bromanyl-2-(2,2-dimethylpropanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate
MOLECULAR FORMULA: C18H25Br2N3O6
MOLECULAR WEIGHT: 539.2156
SMILES: C/C(=C\COC(=O)C(C1=C(C(=O)N=C(N1)NC(=O)C(C)(C)C)Br)Br)/C(OC)OC
Structure:
CAS RN: 86944-13-0
CAS Name: 2-[4-oxo-2-(1-oxooctadecylamino)-1H-pyrimidin-6-yl]acetic acid [(E)-4,4-dimethoxy-3-methylbut-2-enyl] ester
OPENEYE Name: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[2-(octadecanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
IUPAC Name: [(E)-4,4-dimethoxy-3-methylbut-2-enyl] 2-[2-(octadecanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
SYSTEMATIC NAME: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[2-(octadecanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate
MOLECULAR FORMULA: C31H53N3O6
MOLECULAR WEIGHT: 563.76902
SMILES: CCCCCCCCCCCCCCCCCC(=O)NC1=NC(=O)C=C(N1)CC(=O)OC/C=C(\C)/C(OC)OC
Structure:
CAS RN: 86944-12-9
CAS Name: 2-[2-[(2,2-dimethyl-1-oxopropyl)amino]-4-oxo-1H-pyrimidin-6-yl]acetic acid [(E)-4,4-dimethoxy-3-methylbut-2-enyl] ester
OPENEYE Name: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
IUPAC Name: [(E)-4,4-dimethoxy-3-methylbut-2-enyl] 2-[2-(2,2-dimethylpropanoylamino)-4-oxo-1H-pyrimidin-6-yl]acetate
SYSTEMATIC NAME: [(E)-4,4-dimethoxy-3-methyl-but-2-enyl] 2-[2-(2,2-dimethylpropanoylamino)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate
MOLECULAR FORMULA: C18H27N3O6
MOLECULAR WEIGHT: 381.42348
SMILES: C/C(=C\COC(=O)CC1=CC(=O)N=C(N1)NC(=O)C(C)(C)C)/C(OC)OC
Structure:
CAS RN: 86321-30-4
CAS Name: (E)-3-(3-sulfooxyphenyl)-2-propenoic acid
OPENEYE Name: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid
IUPAC Name: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid
SYSTEMATIC NAME: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid
MOLECULAR FORMULA: C9H8O6S
MOLECULAR WEIGHT: 244.22122
SMILES: C1=CC(=CC(=C1)OS(=O)(=O)O)/C=C/C(=O)O
Structure:
CAS RN: 86321-24-6
CAS Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-carboxyethenyl]-2-methoxyphenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-carboxyvinyl]-2-methoxy-phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-carboxyethenyl]-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6S)-6-[2-methoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C16H18O10
MOLECULAR WEIGHT: 370.30812
SMILES: COC1=C(C=CC(=C1)/C=C/C(=O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
Structure:
CAS RN: 86288-11-1
CAS Name: [(2R)-3-hexadecoxy-2-[(5Z,8Z,11Z,14Z)-1-oxoeicosa-5,8,11,14-tetraenoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-3-hexadecoxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-3-hexadecoxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-3-hexadecoxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C44H82NO7P
MOLECULAR WEIGHT: 768.098141
SMILES: CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
Structure:
CAS RN: 84968-50-3
CAS Name: 2-(3-bromophenyl)-3-[3-methyl-5-[(E)-2-phenylethenyl]-4-isoxazolyl]-4-thiazolidinone
OPENEYE Name: 2-(3-bromophenyl)-3-[3-methyl-5-[(E)-styryl]isoxazol-4-yl]thiazolidin-4-one
IUPAC Name: 2-(3-bromophenyl)-3-[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 2-(3-bromophenyl)-3-[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C21H17BrN2O2S
MOLECULAR WEIGHT: 441.34088
SMILES: CC1=NOC(=C1N2C(SCC2=O)C3=CC(=CC=C3)Br)/C=C/C4=CC=CC=C4
Structure:
CAS RN: 84303-90-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H44O6Si
MOLECULAR WEIGHT: 492.72016
SMILES: CC1=C[C@@H]2[C@](CC1)(C3([C@@H](C[C@H](C34CO4)O2)O)C)COC(=O)/C=C(\C)/CCO[Si](C)(C)C(C)(C)C
Structure:
CAS RN: 84303-84-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H37O10P
MOLECULAR WEIGHT: 528.529041
SMILES: CC1=C[C@@H]2[C@](CC1)(C3([C@@H](C[C@H](C34CO4)O2)O)C)COC(=O)/C=C(\C)/CCOC(=O)CP(=O)(OC)OC
Structure:
CAS RN: 84249-68-3
CAS Name: 1-[(Z)-2-(2-methoxyphenyl)prop-1-enyl]-3-methylnaphthalene
OPENEYE Name: 1-[(Z)-2-(2-methoxyphenyl)prop-1-enyl]-3-methyl-naphthalene
IUPAC Name: 1-[(Z)-2-(2-methoxyphenyl)prop-1-enyl]-3-methylnaphthalene
SYSTEMATIC NAME: 1-[(Z)-2-(2-methoxyphenyl)prop-1-enyl]-3-methyl-naphthalene
MOLECULAR FORMULA: C21H20O
MOLECULAR WEIGHT: 288.3829
SMILES: CC1=CC2=CC=CC=C2C(=C1)/C=C(/C)\C3=CC=CC=C3OC
Structure:
CAS RN: 84249-66-1
CAS Name: 1-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]-4-methylnaphthalene
OPENEYE Name: 1-[(E)-2-(2-methoxyphenyl)-1-methyl-vinyl]-4-methyl-naphthalene
IUPAC Name: 1-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]-4-methylnaphthalene
SYSTEMATIC NAME: 1-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]-4-methyl-naphthalene
MOLECULAR FORMULA: C21H20O
MOLECULAR WEIGHT: 288.3829
SMILES: CC1=CC=C(C2=CC=CC=C12)/C(=C/C3=CC=CC=C3OC)/C
Structure:
CAS RN: 83920-73-4
CAS Name:
OPENEYE Name:
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SYSTEMATIC NAME:
MOLECULAR FORMULA: C35H42O9
MOLECULAR WEIGHT: 606.70258
SMILES: C/C=C(\C)/C(=O)OCC1(C2C1(CC(C3(C2C=C(CC4(C3C=C(C4=O)C)O)COC(=O)C)O)C)OC(=O)CC5=CC=CC=C5)C
Structure:
CAS RN: 83920-71-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H44O6
MOLECULAR WEIGHT: 500.66676
SMILES: CCCCCCC/C=C/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C
Structure:
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