CAS RN: 76607-94-8
CAS Name: 3-[(E)-heptadec-1-enyl]benzene-1,2-diol
OPENEYE Name: 3-[(E)-heptadec-1-enyl]benzene-1,2-diol
IUPAC Name: 3-[(E)-heptadec-1-enyl]benzene-1,2-diol
SYSTEMATIC NAME: 3-[(E)-heptadec-1-enyl]benzene-1,2-diol
MOLECULAR FORMULA: C23H38O2
MOLECULAR WEIGHT: 346.54662
SMILES: CCCCCCCCCCCCCCC/C=C/C1=C(C(=CC=C1)O)O
Structure:
CAS RN: 136440-72-7
CAS Name: (13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyprop-2-enyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione
OPENEYE Name: (13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyallyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione
IUPAC Name: (13Z)-5,6,7,11-tetrahydroxy-3-[(E)-3-hydroxyprop-2-enyl]-4,7,9,13,14-pentamethyl-1-oxacyclotetradec-13-ene-2,10-dione
SYSTEMATIC NAME: (13Z)-4,7,9,13,14-pentamethyl-5,6,7,11-tetrakis(oxidanyl)-3-[(E)-3-oxidanylprop-2-enyl]-1-oxacyclotetradec-13-ene-2,10-dione
MOLECULAR FORMULA: C21H34O8
MOLECULAR WEIGHT: 414.48986
SMILES: CC1CC(C(C(C(C(C(=O)O/C(=C(\CC(C1=O)O)/C)/C)C/C=C/O)C)O)O)(C)O
Structure:
CAS RN: 81010-23-3
CAS Name: acetic acid [(2Z,7R,11S)-15,17-dihydroxy-11-methyl-13-oxo-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraen-7-yl] ester
OPENEYE Name: [(2Z,7R,11S)-15,17-dihydroxy-11-methyl-13-oxo-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraen-7-yl] acetate
IUPAC Name: [(2Z,7R,11S)-15,17-dihydroxy-11-methyl-13-oxo-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraen-7-yl] acetate
SYSTEMATIC NAME: [(2Z,7R,11S)-11-methyl-15,17-bis(oxidanyl)-13-oxidanylidene-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraen-7-yl] ethanoate
MOLECULAR FORMULA: C20H26O6
MOLECULAR WEIGHT: 362.41684
SMILES: C[C@H]1CCC[C@@H](CCC/C=C\C2=CC(=CC(=C2C(=O)O1)O)O)OC(=O)C
Structure:
CAS RN: 80618-95-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H37NO4
MOLECULAR WEIGHT: 451.59768
SMILES: CC1C/C=C/C2C3C(O3)(C(C4C2(C(/C=C/C(C1)(C)O)O)C(=O)NC4CC5=CC=CC=C5)C)C
Structure:
CAS RN: 79639-28-4
CAS Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-chloro-1-(4-methoxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-chloro-1-(4-methoxyphenyl)vinyl]phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-chloro-1-(4-methoxyphenyl)ethenyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6S)-6-[4-[(E)-2-chloranyl-1-(4-methoxyphenyl)ethenyl]phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C21H21ClO8
MOLECULAR WEIGHT: 436.83964
SMILES: COC1=CC=C(C=C1)/C(=C\Cl)/C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O
Structure:
CAS RN: 78592-77-5
CAS Name: tert-butyl-[(E)-4-iodo-3-methylbut-3-enoxy]-dimethylsilane
OPENEYE Name: tert-butyl-[(E)-4-iodo-3-methyl-but-3-enoxy]-dimethyl-silane
IUPAC Name: tert-butyl-[(E)-4-iodo-3-methylbut-3-enoxy]-dimethylsilane
SYSTEMATIC NAME: tert-butyl-[(E)-4-iodanyl-3-methyl-but-3-enoxy]-dimethyl-silane
MOLECULAR FORMULA: C11H23IOSi
MOLECULAR WEIGHT: 326.28969
SMILES: C/C(=C\I)/CCO[Si](C)(C)C(C)(C)C
Structure:
CAS RN: 78513-20-9
CAS Name: (E)-2-methyl-2-butenoic acid [(7S,8R)-7-[(E)-2-methyl-1-oxobut-2-enoxy]-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [(7S,8R)-7-[(E)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
IUPAC Name: [(7S,8R)-7-[(E)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
SYSTEMATIC NAME: [(7S,8R)-7-[(E)-2-methylbut-2-enoyl]oxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: C/C=C(\C)/C(=O)OCC1=CCN2[C@H]1[C@H](CC2)OC(=O)/C(=C/C)/C
Structure:
CAS RN: 78472-06-7
CAS Name: (E)-2-methyl-2-butenoic acid [1-methyl-3-[[(E)-2-methyl-1-oxobut-2-enoxy]methyl]-2,5-dihydropyrrol-2-yl]methyl ester
OPENEYE Name: [1-methyl-3-[[(E)-2-methylbut-2-enoyl]oxymethyl]-2,5-dihydropyrrol-2-yl]methyl (E)-2-methylbut-2-enoate
IUPAC Name: [1-methyl-3-[[(E)-2-methylbut-2-enoyl]oxymethyl]-2,5-dihydropyrrol-2-yl]methyl (E)-2-methylbut-2-enoate
SYSTEMATIC NAME: [1-methyl-3-[[(E)-2-methylbut-2-enoyl]oxymethyl]-2,5-dihydropyrrol-2-yl]methyl (E)-2-methylbut-2-enoate
MOLECULAR FORMULA: C17H25NO4
MOLECULAR WEIGHT: 307.3847
SMILES: C/C=C(\C)/C(=O)OCC1C(=CCN1C)COC(=O)/C(=C/C)/C
Structure:
CAS RN: 78472-02-3
CAS Name: (E)-2-methyl-2-butenoic acid [(7R,8R)-7-(ethylcarbamoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [(7R,8R)-7-(ethylcarbamoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
IUPAC Name: [(7R,8R)-7-(ethylcarbamoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
SYSTEMATIC NAME: [(7R,8R)-7-(ethylcarbamoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (E)-2-methylbut-2-enoate
MOLECULAR FORMULA: C16H24N2O4
MOLECULAR WEIGHT: 308.37276
SMILES: CCNC(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)/C(=C/C)/C
Structure:
CAS RN: 77550-17-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H46O8
MOLECULAR WEIGHT: 606.74564
SMILES: CCC/C=C/C=C/C=C/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)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)C)O)C
Structure:
CAS RN: 75961-58-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H43ClO13
MOLECULAR WEIGHT: 671.12902
SMILES: CCCC(=O)OC1CC(C(C2C1(C(/C=C\C(=C)C(C3C(C2OC(=O)C)(C(C(=O)O3)C)OC(=O)C)Cl)O)C)(C)OC(=O)C)OC(=O)C
Structure:
CAS RN: 74145-73-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H40O6
MOLECULAR WEIGHT: 448.5922
SMILES: CCCC(=O)OC1C(CC2C(COC3(C(C/C=C(\CC4C1C2C3O4)/C)OC(=O)C)C)C)C
Structure:
CAS RN: 74219-41-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H40O6
MOLECULAR WEIGHT: 448.5922
SMILES: CCCC(=O)OC1C(CC2C(COC3(C(C/C=C(\CC4C1C2C3O4)/C)OC(=O)C)C)C)C
Structure:
CAS RN: 73023-90-2
CAS Name: 2-[(E)-2-methoxyethenyl]-5-nitrofuran
OPENEYE Name: 2-[(E)-2-methoxyvinyl]-5-nitro-furan
IUPAC Name: 2-[(E)-2-methoxyethenyl]-5-nitrofuran
SYSTEMATIC NAME: 2-[(E)-2-methoxyethenyl]-5-nitro-furan
MOLECULAR FORMULA: C7H7NO4
MOLECULAR WEIGHT: 169.13478
SMILES: CO/C=C/C1=CC=C(O1)[N+](=O)[O-]
Structure:
CAS RN: 71733-45-4
CAS Name: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid [(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]-1-cyclopent-2-enyl] ester; (1R,3R)-3-[(Z)-3-methoxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid [(1S)-2-met
OPENEYE Name: [(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate; [(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(Z)-3-methoxy-2-methyl-3-oxo-prop-1-enyl]
IUPAC Name: [(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate; [(1S)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(Z)-3-methoxy-2-methyl-3-oxoprop-1-eny
SYSTEMATIC NAME: [(1S)-2-methyl-4-oxidanylidene-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate; [(1S)-2-methyl-4-oxidanylidene-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-3-[(Z)-3-methoxy-2-me
MOLECULAR FORMULA: C43H56O8
MOLECULAR WEIGHT: 700.89994
SMILES: CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C)C/C=C/C=C.CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2(C)C)/C=C(/C)\C(=O)OC)C/C=C/C=C
Structure:
CAS RN: 70981-24-7
CAS Name: (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecin-2,9-dione
OPENEYE Name: (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione
IUPAC Name: (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione
SYSTEMATIC NAME: (6Z,8aR,11aR)-1,4,5,8,8a,10,11,11a-octahydrocyclopenta[d]oxecine-2,9-dione
MOLECULAR FORMULA: C12H16O3
MOLECULAR WEIGHT: 208.25364
SMILES: C/1COC(=O)C[C@H]2CCC(=O)[C@@H]2C/C=C1
Structure:
CAS RN: 70872-79-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H50O7
MOLECULAR WEIGHT: 546.7352
SMILES: CCCCCC(=O)OC1C(CC2(C1C(C3(CCC4C(C4(C)C)/C=C(\C2=O)/C)CO3)OC(=O)CCCCC)O)C
Structure:
CAS RN: 61630-47-5
CAS Name: 2-[(1Z,3Z,5Z,7Z)-9-butoxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene
OPENEYE Name: 2-[(1Z,3Z,5Z,7Z)-9-butoxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-1,3,3-trimethyl-cyclohexene
IUPAC Name: 2-[(1Z,3Z,5Z,7Z)-9-butoxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-1,3,3-trimethylcyclohexene
SYSTEMATIC NAME: 2-[(1Z,3Z,5Z,7Z)-9-butoxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-1,3,3-trimethyl-cyclohexene
MOLECULAR FORMULA: C24H38O
MOLECULAR WEIGHT: 342.55792
SMILES: CCCCOC/C=C(/C)\C=C/C=C(/C)\C=C/C1=C(CCCC1(C)C)C
Structure:
CAS RN: 57579-49-4
CAS Name: (Z)-N,N-dimethyl-1,2-diphenylethenamine
OPENEYE Name: (Z)-N,N-dimethyl-1,2-diphenyl-ethenamine
IUPAC Name: (Z)-N,N-dimethyl-1,2-diphenylethenamine
SYSTEMATIC NAME: (Z)-N,N-dimethyl-1,2-diphenyl-ethenamine
MOLECULAR FORMULA: C16H17N
MOLECULAR WEIGHT: 223.31288
SMILES: CN(C)/C(=C\C1=CC=CC=C1)/C2=CC=CC=C2
Structure:
CAS RN: 54984-65-5
CAS Name: (1S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid
OPENEYE Name: (1S)-3-[(E)-3-hydroxy-2-methyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid
IUPAC Name: (1S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid
SYSTEMATIC NAME: (1S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxidanyl-prop-1-enyl]cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C10H16O3
MOLECULAR WEIGHT: 184.23224
SMILES: C/C(=C\C1[C@@H](C1(C)C)C(=O)O)/CO
Structure:
CAS RN: 54984-66-6
CAS Name: (1S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid
OPENEYE Name: (1S)-3-[(E)-3-hydroxy-2-methyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid
IUPAC Name: (1S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid
SYSTEMATIC NAME: (1S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxidanyl-prop-1-enyl]cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C10H16O3
MOLECULAR WEIGHT: 184.23224
SMILES: C/C(=C\C1[C@@H](C1(C)C)C(=O)O)/CO
Structure:
CAS RN: 54324-45-7
CAS Name: [2-[(Z)-1-oxohexadec-9-enoxy]-3-(1-oxohexadecoxy)propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [3-hexadecanoyloxy-2-[(Z)-hexadec-9-enoyl]oxy-propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [3-hexadecanoyloxy-2-[(Z)-hexadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [3-hexadecanoyloxy-2-[(Z)-hexadec-9-enoyl]oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C40H78NO8P
MOLECULAR WEIGHT: 732.022981
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCC
Structure:
CAS RN: 138876-22-9
CAS Name: (2R)-2-amino-3-[[(E)-3-chloroprop-2-enyl]thio]propanoic acid
OPENEYE Name: (2R)-2-amino-3-[(E)-3-chloroallyl]sulfanyl-propanoic acid
IUPAC Name: (2R)-2-amino-3-[(E)-3-chloroprop-2-enyl]sulfanylpropanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-[(E)-3-chloranylprop-2-enyl]sulfanyl-propanoic acid
MOLECULAR FORMULA: C6H10ClNO2S
MOLECULAR WEIGHT: 195.6671
SMILES: C(/C=C/Cl)SC[C@@H](C(=O)O)N
Structure:
CAS RN: 138881-74-0
CAS Name: (2R)-2-amino-3-[[(E)-3-chloroprop-2-enyl]thio]propanoic acid
OPENEYE Name: (2R)-2-amino-3-[(E)-3-chloroallyl]sulfanyl-propanoic acid
IUPAC Name: (2R)-2-amino-3-[(E)-3-chloroprop-2-enyl]sulfanylpropanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-[(E)-3-chloranylprop-2-enyl]sulfanyl-propanoic acid
MOLECULAR FORMULA: C6H10ClNO2S
MOLECULAR WEIGHT: 195.6671
SMILES: C(/C=C/Cl)SC[C@@H](C(=O)O)N
Structure:
CAS RN: 133872-50-1
CAS Name: (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[[(E)-4-hydroxybut-2-enyl]thio]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
OPENEYE Name: (2S)-2-amino-5-[[(1R)-2-(carboxymethylamino)-1-[[(E)-4-hydroxybut-2-enyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
IUPAC Name: (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-4-hydroxybut-2-enyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-5-[[(2R)-1-(2-hydroxy-2-oxoethylamino)-3-[(E)-4-oxidanylbut-2-enyl]sulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C14H23N3O7S
MOLECULAR WEIGHT: 377.41332
SMILES: C(CC(=O)N[C@@H](CSC/C=C/CO)C(=O)NCC(=O)O)[C@@H](C(=O)O)N
Structure:
CAS RN: 93132-78-6
CAS Name: (1S,3S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxoprop-1-enyl]-1-cyclopropanecarboxylic acid
OPENEYE Name: (1S,3S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxo-prop-1-enyl]cyclopropanecarboxylic acid
IUPAC Name: (1S,3S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxoprop-1-enyl]cyclopropane-1-carboxylic acid
SYSTEMATIC NAME: (1S,3S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxidanylidene-prop-1-enyl]cyclopropane-1-carboxylic acid
MOLECULAR FORMULA: C10H14O3
MOLECULAR WEIGHT: 182.21636
SMILES: C/C(=C\[C@H]1[C@@H](C1(C)C)C(=O)O)/C=O
Structure:
CAS RN: 93132-75-3
CAS Name: (1S,3R)-3-[(Z)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid methyl ester
OPENEYE Name: methyl (1S,3R)-3-[(Z)-3-hydroxy-2-methyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: methyl (1S,3R)-3-[(Z)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: methyl (1S,3R)-2,2-dimethyl-3-[(Z)-2-methyl-3-oxidanyl-prop-1-enyl]cyclopropane-1-carboxylate
MOLECULAR FORMULA: C11H18O3
MOLECULAR WEIGHT: 198.25882
SMILES: C/C(=C/[C@@H]1[C@@H](C1(C)C)C(=O)OC)/CO
Structure:
CAS RN: 93132-72-0
CAS Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(1R,3R)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropyl]-oxomethoxy]-2-oxanecarboxylic acid
OPENEYE Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(1R,3R)-3-[(E)-3-hydroxy-2-methyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarbonyl]oxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(1R,3R)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropanecarbonyl]oxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3S,4S,5R,6R)-6-[(1R,3R)-2,2-dimethyl-3-[(E)-2-methyl-3-oxidanyl-prop-1-enyl]cyclopropyl]carbonyloxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C16H24O9
MOLECULAR WEIGHT: 360.35636
SMILES: C/C(=C\[C@@H]1[C@H](C1(C)C)C(=O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)/CO
Structure:
CAS RN: 93132-66-2
CAS Name: (1S,3S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid methyl ester
OPENEYE Name: methyl (1S,3S)-3-[(E)-3-hydroxy-2-methyl-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate
IUPAC Name: methyl (1S,3S)-3-[(E)-3-hydroxy-2-methylprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
SYSTEMATIC NAME: methyl (1S,3S)-2,2-dimethyl-3-[(E)-2-methyl-3-oxidanyl-prop-1-enyl]cyclopropane-1-carboxylate
MOLECULAR FORMULA: C11H18O3
MOLECULAR WEIGHT: 198.25882
SMILES: C/C(=C\[C@H]1[C@@H](C1(C)C)C(=O)OC)/CO
Structure:
CAS RN: 90028-85-6
CAS Name: 2-[(E)-1-(4-chlorophenyl)-2-phenylethenyl]-3-methylbenzofuran
OPENEYE Name: 2-[(E)-1-(4-chlorophenyl)-2-phenyl-vinyl]-3-methyl-benzofuran
IUPAC Name: 2-[(E)-1-(4-chlorophenyl)-2-phenylethenyl]-3-methyl-1-benzofuran
SYSTEMATIC NAME: 2-[(E)-1-(4-chlorophenyl)-2-phenyl-ethenyl]-3-methyl-1-benzofuran
MOLECULAR FORMULA: C23H17ClO
MOLECULAR WEIGHT: 344.83348
SMILES: CC1=C(OC2=CC=CC=C12)/C(=C/C3=CC=CC=C3)/C4=CC=C(C=C4)Cl
Structure:
CAS RN: 89999-00-8
CAS Name: 2-[(E)-1-(4-bromophenyl)-2-phenylethenyl]benzofuran
OPENEYE Name: 2-[(E)-1-(4-bromophenyl)-2-phenyl-vinyl]benzofuran
IUPAC Name: 2-[(E)-1-(4-bromophenyl)-2-phenylethenyl]-1-benzofuran
SYSTEMATIC NAME: 2-[(E)-1-(4-bromophenyl)-2-phenyl-ethenyl]-1-benzofuran
MOLECULAR FORMULA: C22H15BrO
MOLECULAR WEIGHT: 375.2579
SMILES: C1=CC=C(C=C1)/C=C(\C2=CC=C(C=C2)Br)/C3=CC4=CC=CC=C4O3
Structure:
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