CAS RN: 82837-65-8
CAS Name: 3-[[(E)-2-acetamidoethenyl]thio]-7-oxo-6-propan-2-yl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
OPENEYE Name: 3-[(E)-2-acetamidovinyl]sulfanyl-6-isopropyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
IUPAC Name: 3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxo-6-propan-2-yl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxidanylidene-6-propan-2-yl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H18N2O4S
MOLECULAR WEIGHT: 310.36872
SMILES: CC(C)C1C2CC(=C(N2C1=O)C(=O)O)S/C=C/NC(=O)C
Structure:
CAS RN: 82699-01-2
CAS Name: acetic acid [4-[(E)-1-[(2R,3R)-2-(4-acetyloxyphenyl)-3-methyl-2-oxiranyl]prop-1-enyl]phenyl] ester
OPENEYE Name: [4-[(E)-1-[(2R,3R)-2-(4-acetoxyphenyl)-3-methyl-oxiran-2-yl]prop-1-enyl]phenyl] acetate
IUPAC Name: [4-[(E)-1-[(2R,3R)-2-(4-acetyloxyphenyl)-3-methyloxiran-2-yl]prop-1-enyl]phenyl] acetate
SYSTEMATIC NAME: [4-[(E)-1-[(2R,3R)-2-(4-acetyloxyphenyl)-3-methyl-oxiran-2-yl]prop-1-enyl]phenyl] ethanoate
MOLECULAR FORMULA: C22H22O5
MOLECULAR WEIGHT: 366.40708
SMILES: C/C=C(\C1=CC=C(C=C1)OC(=O)C)/[C@@]2([C@H](O2)C)C3=CC=C(C=C3)OC(=O)C
Structure:
CAS RN: 82647-22-1
CAS Name: (E)-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-2-propenamide
OPENEYE Name: (E)-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
IUPAC Name: (E)-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-N-[(1R,2R)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]prop-2-enamide
MOLECULAR FORMULA: C17H18N4O7
MOLECULAR WEIGHT: 390.34742
SMILES: CC1=C(C(=O)NC(=O)N1)/C=C/C(=O)N[C@H](CO)[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:
CAS RN: 71441-32-2
CAS Name: 6-[(E)-1-[4-(methoxymethyl)phenyl]prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
OPENEYE Name: 6-[(E)-2-[4-(methoxymethyl)phenyl]-1-methyl-vinyl]-1,1,4,4-tetramethyl-tetralin
IUPAC Name: 6-[(E)-1-[4-(methoxymethyl)phenyl]prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
SYSTEMATIC NAME: 6-[(E)-1-[4-(methoxymethyl)phenyl]prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
MOLECULAR FORMULA: C25H32O
MOLECULAR WEIGHT: 348.52098
SMILES: C/C(=C\C1=CC=C(C=C1)COC)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C
Structure:
CAS RN: 71441-29-7
CAS Name: N-ethyl-4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzamide
OPENEYE Name: N-ethyl-4-[(E)-2-(1,1,4,4-tetramethyltetralin-6-yl)prop-1-enyl]benzamide
IUPAC Name: N-ethyl-4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzamide
SYSTEMATIC NAME: N-ethyl-4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzamide
MOLECULAR FORMULA: C26H33NO
MOLECULAR WEIGHT: 375.54632
SMILES: CCNC(=O)C1=CC=C(C=C1)/C=C(\C)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C
Structure:
CAS RN: 143800-82-2
CAS Name: (Z,2S)-2-amino-4-(methylthio)-3-butenoic acid
OPENEYE Name: (Z,2S)-2-amino-4-methylsulfanyl-but-3-enoic acid
IUPAC Name: (Z,2S)-2-amino-4-methylsulfanylbut-3-enoic acid
SYSTEMATIC NAME: (Z,2S)-2-azanyl-4-methylsulfanyl-but-3-enoic acid
MOLECULAR FORMULA: C5H9NO2S
MOLECULAR WEIGHT: 147.19546
SMILES: CS/C=C\[C@@H](C(=O)O)N
Structure:
CAS RN: 114390-31-7
CAS Name: (2Z)-2-[2-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxy-1-oxoethyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-4-oxanyl]amino]-2-oxoethylidene]butanedioic acid
OPENEYE Name: (2Z)-2-[2-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]tetrahydropyran-4-yl]amino]-2-oxo-ethylidene]butanedioic acid
IUPAC Name: (2Z)-2-[2-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]amino]-2-oxoethylidene]butanedioic acid
SYSTEMATIC NAME: (2Z)-2-[2-[[(2S,3S,4S,6R)-6-[[(1S,3S)-10-methoxy-3,5,12-tris(oxidanyl)-3-(2-oxidanylethanoyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]amino]-2-oxidanylidene-ethylidene]butanedioic acid
MOLECULAR FORMULA: C33H33NO16
MOLECULAR WEIGHT: 699.61222
SMILES: C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)NC(=O)/C=C(/CC(=O)O)\C(=O)O)O
Structure:
CAS RN: 82535-65-7
CAS Name: 5-(dimethylamino)-N-[(E,2R,3S)-3-hydroxy-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]octadec-4-en-2-yl]-1-naphthalenesulfonamide
OPENEYE Name: 5-(dimethylamino)-N-[(E,1R,2S)-2-hydroxy-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]heptadec-3-enyl]naphthalene-1-sulfonamide
IUPAC Name: 5-(dimethylamino)-N-[(E,2R,3S)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]naphthalene-1-sulfonamide
SYSTEMATIC NAME: 5-(dimethylamino)-N-[(E,2R,3S)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-octadec-4-en-2-yl]naphthalene-1-sulfonamide
MOLECULAR FORMULA: C36H58N2O9S
MOLECULAR WEIGHT: 694.91872
SMILES: CCCCCCCCCCCCC/C=C/[C@@H]([C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C)O
Structure:
CAS RN: 82516-67-4
CAS Name: 5-[5-hydroxy-2-oxo-3-[[(2E)-4,6,8-trimethyl-1-oxonona-2,7-dienyl]amino]-7-oxabicyclo[4.1.0]hept-3-en-5-yl]pentanoic acid
OPENEYE Name: 5-[5-hydroxy-2-oxo-3-[[(2E)-4,6,8-trimethylnona-2,7-dienoyl]amino]-7-oxabicyclo[4.1.0]hept-3-en-5-yl]pentanoic acid
IUPAC Name: 5-[5-hydroxy-2-oxo-3-[[(2E)-4,6,8-trimethylnona-2,7-dienoyl]amino]-7-oxabicyclo[4.1.0]hept-3-en-5-yl]pentanoic acid
SYSTEMATIC NAME: 5-[5-oxidanyl-2-oxidanylidene-3-[[(2E)-4,6,8-trimethylnona-2,7-dienoyl]amino]-7-oxabicyclo[4.1.0]hept-3-en-5-yl]pentanoic acid
MOLECULAR FORMULA: C23H33NO6
MOLECULAR WEIGHT: 419.51122
SMILES: CC(CC(C)C=C(C)C)/C=C/C(=O)NC1=CC(C2C(C1=O)O2)(CCCCC(=O)O)O
Structure:
CAS RN: 82501-56-2
CAS Name: (2E)-2-(3-amino-5-oxo-2-furanylidene)acetaldehyde
OPENEYE Name: (2E)-2-(3-amino-5-oxo-2-furylidene)acetaldehyde
IUPAC Name: (2E)-2-(3-amino-5-oxofuran-2-ylidene)acetaldehyde
SYSTEMATIC NAME: (2E)-2-(3-azanyl-5-oxidanylidene-furan-2-ylidene)ethanal
MOLECULAR FORMULA: C6H5NO3
MOLECULAR WEIGHT: 139.1088
SMILES: C1=C(/C(=C\C=O)/OC1=O)N
Structure:
CAS RN: 82425-48-7
CAS Name: (E)-2-(hydroxymethyl)-3-[(1S,6S)-3-(hydroxymethyl)-6-propan-2-yl-1-cyclohex-2-enyl]-2-propenoic acid
OPENEYE Name: (E)-2-(hydroxymethyl)-3-[(1S,6S)-3-(hydroxymethyl)-6-isopropyl-cyclohex-2-en-1-yl]prop-2-enoic acid
IUPAC Name: (E)-2-(hydroxymethyl)-3-[(1S,6S)-3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoic acid
SYSTEMATIC NAME: (E)-2-(hydroxymethyl)-3-[(1S,6S)-3-(hydroxymethyl)-6-propan-2-yl-cyclohex-2-en-1-yl]prop-2-enoic acid
MOLECULAR FORMULA: C14H22O4
MOLECULAR WEIGHT: 254.32208
SMILES: CC(C)[C@@H]1CCC(=C[C@H]1/C=C(\CO)/C(=O)O)CO
Structure:
CAS RN: 82402-68-4
CAS Name: (E)-7-[3-(2-hydroxydecylamino)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]-5-heptenoic acid
OPENEYE Name: (E)-7-[3-(2-hydroxydecylamino)-6,6-dimethyl-norpinan-2-yl]hept-5-enoic acid
IUPAC Name: (E)-7-[3-(2-hydroxydecylamino)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
SYSTEMATIC NAME: (E)-7-[6,6-dimethyl-3-(2-oxidanyldecylamino)-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
MOLECULAR FORMULA: C26H47NO3
MOLECULAR WEIGHT: 421.65628
SMILES: CCCCCCCCC(CNC1CC2CC(C1C/C=C/CCCC(=O)O)C2(C)C)O
Structure:
CAS RN: 82251-59-0
CAS Name: (3S,8S,9S,10R,11R,13R,14S,15R,17R)-3,11,15-trihydroxy-17-[(E,2R)-7-hydroxy-5-propan-2-ylhept-5-en-2-yl]-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
OPENEYE Name: (3S,8S,9S,10R,11R,13R,14S,15R,17R)-3,11,15-trihydroxy-17-[(E,1R)-6-hydroxy-4-isopropyl-1-methyl-hex-4-enyl]-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
IUPAC Name: (3S,8S,9S,10R,11R,13R,14S,15R,17R)-3,11,15-trihydroxy-17-[(E,2R)-7-hydroxy-5-propan-2-ylhept-5-en-2-yl]-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
SYSTEMATIC NAME: (3S,8S,9S,10R,11R,13R,14S,15R,17R)-10,13-dimethyl-3,11,15-tris(oxidanyl)-17-[(E,2R)-7-oxidanyl-5-propan-2-yl-hept-5-en-2-yl]-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
MOLECULAR FORMULA: C29H46O5
MOLECULAR WEIGHT: 474.67254
SMILES: C[C@H](CC/C(=C\CO)/C(C)C)[C@H]1C[C@H]([C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)O)C)O
Structure:
CAS RN: 82209-76-5
CAS Name: (3E,4S)-3-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxy-2-oxolanone
OPENEYE Name: (3E,4S)-3-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]decalin-1-yl]ethylidene]-4-hydroxy-tetrahydrofuran-2-one
IUPAC Name: (3E,4S)-3-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one
SYSTEMATIC NAME: (3E,4S)-3-[2-[(4aS,5R,6R,8aS)-5-[[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-5,8a-dimethyl-2-methylidene-6-oxidanyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-oxidanyl-oxolan-2-one
MOLECULAR FORMULA: C26H40O10
MOLECULAR WEIGHT: 512.5898
SMILES: C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)C2C/C=C/3\[C@@H](COC3=O)O)(C)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
Structure:
CAS RN: 82188-63-4
CAS Name: [(2R)-3-(1-oxohexadecoxy)-2-[(9Z,11Z,13Z,15Z)-1-oxooctadeca-9,11,13,15-tetraenoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-3-hexadecanoyloxy-2-[(9Z,11Z,13Z,15Z)-octadeca-9,11,13,15-tetraenoyl]oxy-propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-3-hexadecanoyloxy-2-[(9Z,11Z,13Z,15Z)-octadeca-9,11,13,15-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-3-hexadecanoyloxy-2-[(9Z,11Z,13Z,15Z)-octadeca-9,11,13,15-tetraenoyl]oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C42H76NO8P
MOLECULAR WEIGHT: 754.028501
SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C=C/C=C\C=C/CC
Structure:
CAS RN: 82144-59-0
CAS Name: (5E,8E,13E)-11,12,15-trihydroxyeicosa-5,8,13-trienoic acid
OPENEYE Name: (5E,8E,13E)-11,12,15-trihydroxyicosa-5,8,13-trienoic acid
IUPAC Name: (5E,8E,13E)-11,12,15-trihydroxyicosa-5,8,13-trienoic acid
SYSTEMATIC NAME: (5E,8E,13E)-11,12,15-tris(oxidanyl)icosa-5,8,13-trienoic acid
MOLECULAR FORMULA: C20H34O5
MOLECULAR WEIGHT: 354.48096
SMILES: CCCCCC(/C=C/C(C(C/C=C/C/C=C/CCCC(=O)O)O)O)O
Structure:
CAS RN: 82095-24-7
CAS Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1,2-dihydroxy-2-methyl-4-heptanone
OPENEYE Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1,2-dihydroxy-2-methyl-heptan-4-one
IUPAC Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1,2-dihydroxy-2-methylheptan-4-one
SYSTEMATIC NAME: (6R)-6-[(1R,3aS,4E,7aR)-7a-methyl-4-[(2Z)-2-[(3R,5S)-2-methylidene-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-1,2-bis(oxidanyl)heptan-4-one
MOLECULAR FORMULA: C27H42O5
MOLECULAR WEIGHT: 446.61938
SMILES: C[C@H](CC(=O)CC(C)(CO)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H](C[C@H](C3=C)O)O)C
Structure:
CAS RN: 82095-23-6
CAS Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-hydroxy-2-methyl-4-heptanone
OPENEYE Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-hydroxy-2-methyl-heptan-4-one
IUPAC Name: (6R)-6-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3R,5S)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-hydroxy-2-methylheptan-4-one
SYSTEMATIC NAME: (6R)-6-[(1R,3aS,4E,7aR)-7a-methyl-4-[(2Z)-2-[(3R,5S)-2-methylidene-3,5-bis(oxidanyl)cyclohexylidene]ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-2-oxidanyl-heptan-4-one
MOLECULAR FORMULA: C27H42O4
MOLECULAR WEIGHT: 430.61998
SMILES: C[C@H](CC(=O)CC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H](C[C@H](C3=C)O)O)C
Structure:
CAS RN: 82006-84-6
CAS Name: (E)-2,5-diamino-2-(fluoromethyl)-3-pentenoic acid
OPENEYE Name: (E)-2,5-diamino-2-(fluoromethyl)pent-3-enoic acid
IUPAC Name: (E)-2,5-diamino-2-(fluoromethyl)pent-3-enoic acid
SYSTEMATIC NAME: (E)-2,5-bis(azanyl)-2-(fluoranylmethyl)pent-3-enoic acid
MOLECULAR FORMULA: C6H11FN2O2
MOLECULAR WEIGHT: 162.162143
SMILES: C(/C=C/C(CF)(C(=O)O)N)N
Structure:
CAS RN: 82006-58-4
CAS Name: (E)-5-fluoro-2-pentene-1,4-diamine
OPENEYE Name: (E)-5-fluoropent-2-ene-1,4-diamine
IUPAC Name: (E)-5-fluoropent-2-ene-1,4-diamine
SYSTEMATIC NAME: (E)-5-fluoranylpent-2-ene-1,4-diamine
MOLECULAR FORMULA: C5H11FN2
MOLECULAR WEIGHT: 118.152643
SMILES: C(/C=C/C(CF)N)N
Structure:
CAS RN: 81957-68-8
CAS Name: 2-[[(5E,7E)-8-[6-(hydroxymethyl)-2,6-dimethyl-3-oxo-1-cyclohexenyl]-2,6-dimethyl-1-oxoocta-5,7-dienyl]amino]ethanesulfonic acid
OPENEYE Name: 2-[[(5E,7E)-8-[6-(hydroxymethyl)-2,6-dimethyl-3-oxo-cyclohexen-1-yl]-2,6-dimethyl-octa-5,7-dienoyl]amino]ethanesulfonic acid
IUPAC Name: 2-[[(5E,7E)-8-[6-(hydroxymethyl)-2,6-dimethyl-3-oxocyclohexen-1-yl]-2,6-dimethylocta-5,7-dienoyl]amino]ethanesulfonic acid
SYSTEMATIC NAME: 2-[[(5E,7E)-8-[6-(hydroxymethyl)-2,6-dimethyl-3-oxidanylidene-cyclohexen-1-yl]-2,6-dimethyl-octa-5,7-dienoyl]amino]ethanesulfonic acid
MOLECULAR FORMULA: C21H33NO6S
MOLECULAR WEIGHT: 427.55482
SMILES: CC1=C(C(CCC1=O)(C)CO)/C=C/C(=C/CCC(C)C(=O)NCCS(=O)(=O)O)/C
Structure:
CAS RN: 81918-96-9
CAS Name: (5Z,8Z,10E,12E)-13-[(2R,3R)-3-pentyl-2-oxiranyl]trideca-5,8,10,12-tetraenoic acid
OPENEYE Name: (5Z,8Z,10E,12E)-13-[(2R,3R)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoic acid
IUPAC Name: (5Z,8Z,10E,12E)-13-[(2R,3R)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoic acid
SYSTEMATIC NAME: (5Z,8Z,10E,12E)-13-[(2R,3R)-3-pentyloxiran-2-yl]trideca-5,8,10,12-tetraenoic acid
MOLECULAR FORMULA: C20H30O3
MOLECULAR WEIGHT: 318.4504
SMILES: CCCCC[C@@H]1[C@H](O1)/C=C/C=C/C=C\C/C=C\CCCC(=O)O
Structure:
CAS RN: 81845-44-5
CAS Name: (5Z)-5-[5-hydroxy-4-[(E)-3-hydroxyoct-1-enyl]-6a-methyl-1,3,3a,4,5,6-hexahydropentalen-2-ylidene]pentanoic acid
OPENEYE Name: (5Z)-5-[5-hydroxy-4-[(E)-3-hydroxyoct-1-enyl]-6a-methyl-1,3,3a,4,5,6-hexahydropentalen-2-ylidene]pentanoic acid
IUPAC Name: (5Z)-5-[5-hydroxy-4-[(E)-3-hydroxyoct-1-enyl]-6a-methyl-1,3,3a,4,5,6-hexahydropentalen-2-ylidene]pentanoic acid
SYSTEMATIC NAME: (5Z)-5-[6a-methyl-5-oxidanyl-4-[(E)-3-oxidanyloct-1-enyl]-1,3,3a,4,5,6-hexahydropentalen-2-ylidene]pentanoic acid
MOLECULAR FORMULA: C22H36O4
MOLECULAR WEIGHT: 364.51884
SMILES: CCCCCC(/C=C/C1C2C/C(=C/CCCC(=O)O)/CC2(CC1O)C)O
Structure:
CAS RN: 81844-74-8
CAS Name: 2-[2,3-bis[(Z)-1-oxooctadec-9-enoxy]propoxy-oxidophosphinothioyl]oxyethyl-trimethylammonium
OPENEYE Name: 2-[2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy-oxido-phosphinothioyl]oxyethyl-trimethyl-ammonium
IUPAC Name: 2-[2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy-oxidophosphinothioyl]oxyethyl-trimethylazanium
SYSTEMATIC NAME: 2-[2,3-bis[[(Z)-octadec-9-enoyl]oxy]propoxy-oxidanidyl-phosphinothioyl]oxyethyl-trimethyl-azanium
MOLECULAR FORMULA: C44H84NO7PS
MOLECULAR WEIGHT: 802.179021
SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COP(=S)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC
Structure:
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