CAS RN: 140156-26-9
CAS Name: 6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1-[(Z)-prop-1-enyl]-2-purinone
OPENEYE Name: 6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-[(Z)-prop-1-enyl]purin-2-one
IUPAC Name: 6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-[(Z)-prop-1-enyl]purin-2-one
SYSTEMATIC NAME: 6-azanyl-9-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1-[(Z)-prop-1-enyl]purin-2-one
MOLECULAR FORMULA: C13H17N5O5
MOLECULAR WEIGHT: 323.30458
SMILES: C/C=C\N1C(=C2C(=NC1=O)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N
Structure:
CAS RN: 139758-69-3
CAS Name: 9-[[(Z)-3-iodoprop-2-enoxy]methyl]-6-purinamine
OPENEYE Name: 9-[[(Z)-3-iodoallyloxy]methyl]purin-6-amine
IUPAC Name: 9-[[(Z)-3-iodoprop-2-enoxy]methyl]purin-6-amine
SYSTEMATIC NAME: 9-[[(Z)-3-iodanylprop-2-enoxy]methyl]purin-6-amine
MOLECULAR FORMULA: C9H10IN5O
MOLECULAR WEIGHT: 331.11307
SMILES: C1=NC2=C(C(=N1)N)N=CN2COC/C=C\I
Structure:
CAS RN: 139628-86-7
CAS Name: (1R,4aR,5S,8aR)-5-[(E)-5-methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
OPENEYE Name: (1R,4aR,5S,8aR)-5-[(E)-5-methoxy-3-methyl-5-oxo-pent-3-enyl]-1,4a-dimethyl-6-methylene-decalin-1-carboxylic acid
IUPAC Name: (1R,4aR,5S,8aR)-5-[(E)-5-methoxy-3-methyl-5-oxopent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
SYSTEMATIC NAME: (1R,4aR,5S,8aR)-5-[(E)-5-methoxy-3-methyl-5-oxidanylidene-pent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
MOLECULAR FORMULA: C21H32O4
MOLECULAR WEIGHT: 348.47638
SMILES: C/C(=C\C(=O)OC)/CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@@]2(C)C(=O)O)C
Structure:
CAS RN: 139595-04-3
CAS Name: carbamic acid [6-[[2-[4-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hydroxypentan-2-yl]-2-hydroxy-5,6-dimethyl-4-oxanyl]oxy]-4-hydroxy-2-methyl-3-oxanyl] ester
OPENEYE Name: [6-[2-[3-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-2-hydroxy-1-methyl-butyl]-2-hydroxy-5,6-dimethyl-tetrahydropyran-4-yl]oxy-4-hydroxy-2-methyl-tetrahydropyran-3-yl] ca
IUPAC Name: [6-[2-[4-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hydroxypentan-2-yl]-2-hydroxy-5,6-dimethyloxan-4-yl]oxy-4-hydroxy-2-methyloxan-3-yl] carbamate
SYSTEMATIC NAME: [6-[2-[4-[(4E,6E,14E,16Z)-11-ethyl-3,17-dimethoxy-7,9,13,15-tetramethyl-10,12-bis(oxidanyl)-18-oxidanylidene-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-oxidanyl-pentan-2-yl]-5,6-dimethyl-2-oxidanyl-oxan-4-yl]oxy-2-methyl-4-oxidanyl-oxan-3-yl] carbamate
MOLECULAR FORMULA: C44H73NO14
MOLECULAR WEIGHT: 840.04872
SMILES: CCC1C(C(C/C(=C/C=C/C(C(OC(=O)/C(=C/C(=C/C(C1O)C)/C)/OC)C(C)C(C(C)C2(CC(C(C(O2)C)C)OC3CC(C(C(O3)C)OC(=O)N)O)O)O)OC)/C)C)O
Structure:
CAS RN: 139595-03-2
CAS Name: (E)-4-[[2-[4-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hydroxypentan-2-yl]-2-hydroxy-5,6-dimethyl-4-oxanyl]oxy]-4-oxo-2-butenoic acid
OPENEYE Name: (E)-4-[2-[3-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-2-hydroxy-1-methyl-butyl]-2-hydroxy-5,6-dimethyl-tetrahydropyran-4-yl]oxy-4-oxo-but-2-enoic acid
IUPAC Name: (E)-4-[2-[4-[(4E,6E,14E,16Z)-11-ethyl-10,12-dihydroxy-3,17-dimethoxy-7,9,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-hydroxypentan-2-yl]-2-hydroxy-5,6-dimethyloxan-4-yl]oxy-4-oxobut-2-enoic acid
SYSTEMATIC NAME: (E)-4-[2-[4-[(4E,6E,14E,16Z)-11-ethyl-3,17-dimethoxy-7,9,13,15-tetramethyl-10,12-bis(oxidanyl)-18-oxidanylidene-1-oxacyclooctadeca-4,6,14,16-tetraen-2-yl]-3-oxidanyl-pentan-2-yl]-5,6-dimethyl-2-oxidanyl-oxan-4-yl]oxy-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C41H64O13
MOLECULAR WEIGHT: 764.93906
SMILES: CCC1C(C(C/C(=C/C=C/C(C(OC(=O)/C(=C/C(=C/C(C1O)C)/C)/OC)C(C)C(C(C)C2(CC(C(C(O2)C)C)OC(=O)/C=C/C(=O)O)O)O)OC)/C)C)O
Structure:
CAS RN: 139592-99-7
CAS Name: [(Z)-3-(3-chloro-4-cyclohexylphenyl)prop-2-enyl]cycloheptane hydrochloride
OPENEYE Name: [(Z)-3-(3-chloro-4-cyclohexyl-phenyl)allyl]cycloheptane hydrochloride
IUPAC Name: [(Z)-3-(3-chloro-4-cyclohexylphenyl)prop-2-enyl]cycloheptane hydrochloride
SYSTEMATIC NAME: [(Z)-3-(3-chloranyl-4-cyclohexyl-phenyl)prop-2-enyl]cycloheptane hydrochloride
MOLECULAR FORMULA: C22H32Cl2
MOLECULAR WEIGHT: 367.39548
SMILES: C1CCCC(CC1)C/C=C\C2=CC(=C(C=C2)C3CCCCC3)Cl.Cl
Structure:
CAS RN: 75879-18-4
CAS Name: 4-[(2R)-3-[(1E,3E,5E,8E)-tetradeca-1,3,5,8-tetraenyl]-2-oxiranyl]butanoic acid methyl ester
OPENEYE Name: methyl 4-[(2R)-3-[(1E,3E,5E,8E)-tetradeca-1,3,5,8-tetraenyl]oxiran-2-yl]butanoate
IUPAC Name: methyl 4-[(2R)-3-[(1E,3E,5E,8E)-tetradeca-1,3,5,8-tetraenyl]oxiran-2-yl]butanoate
SYSTEMATIC NAME: methyl 4-[(2R)-3-[(1E,3E,5E,8E)-tetradeca-1,3,5,8-tetraenyl]oxiran-2-yl]butanoate
MOLECULAR FORMULA: C21H32O3
MOLECULAR WEIGHT: 332.47698
SMILES: CCCCC/C=C/C/C=C/C=C/C=C/C1[C@H](O1)CCCC(=O)OC
Structure:
CAS RN: 75207-09-9
CAS Name: (5S,7E,9E,11Z,14Z,17Z)-6-[[(2R)-2-amino-3-[[(4S)-4-amino-4-carboxy-1-oxobutyl]-(carboxymethyl)amino]-3-oxopropyl]thio]-5-hydroxyeicosa-7,9,11,14,17-pentaenoic acid
OPENEYE Name: (5S,7E,9E,11Z,14Z,17Z)-6-[(2R)-2-amino-3-[[(4S)-4-amino-4-carboxy-butanoyl]-(carboxymethyl)amino]-3-oxo-propyl]sulfanyl-5-hydroxy-icosa-7,9,11,14,17-pentaenoic acid
IUPAC Name: (5S,7E,9E,11Z,14Z,17Z)-6-[(2R)-2-amino-3-[[(4S)-4-amino-4-carboxybutanoyl]-(carboxymethyl)amino]-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11,14,17-pentaenoic acid
SYSTEMATIC NAME: (5S,7E,9E,11Z,14Z,17Z)-6-[(2R)-2-azanyl-3-[[(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]-(2-hydroxy-2-oxoethyl)amino]-3-oxidanylidene-propyl]sulfanyl-5-oxidanyl-icosa-7,9,11,14,17-pentaenoic acid
MOLECULAR FORMULA: C30H45N3O9S
MOLECULAR WEIGHT: 623.758
SMILES: CC/C=C\C/C=C\C/C=C\C=C\C=C\C([C@H](CCCC(=O)O)O)SC[C@@H](C(=O)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N)N
Structure:
CAS RN: 75139-05-8
CAS Name: sodium 5-hydroxy-4-[(2S)-2-[(1S,2S,6R)-2-[(E)-3-hydroxy-2-[(2R,3R)-6-[(E,3S)-3-[(2R,3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyl-2-oxolanyl]but-1-enyl]-3-methyl-2-oxanyl]prop-1-enyl]-6-methylcyclohexyl]-1-oxopropyl]-3-furanone
OPENEYE Name: sodium 5-hydroxy-4-[(2S)-2-[(1S,2S,6R)-2-[(E)-3-hydroxy-2-[(2R,3R)-6-[(E,3S)-3-[(2R,3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyl-tetrahydrofuran-2-yl]but-1-enyl]-3-methyl-tetrahydropyran-2-yl]prop-1-enyl]-6-methyl-cyclohexyl]propanoyl]furan-3-one
IUPAC Name: sodium 5-hydroxy-4-[(2S)-2-[(1S,2S,6R)-2-[(E)-3-hydroxy-2-[(2R,3R)-6-[(E,3S)-3-[(2R,3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyloxolan-2-yl]but-1-enyl]-3-methyloxan-2-yl]prop-1-enyl]-6-methylcyclohexyl]propanoyl]furan-3-one
SYSTEMATIC NAME: sodium 4-[(2S)-2-[(1S,2S,6R)-2-[(E)-2-[(2R,3R)-6-[(E,3S)-3-[(2R,3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyl-oxolan-2-yl]but-1-enyl]-3-methyl-oxan-2-yl]-3-oxidanyl-prop-1-enyl]-6-methyl-cyclohexyl]propanoyl]-5-oxidanyl-furan-3-one
MOLECULAR FORMULA: C35H54NaO8+
MOLECULAR WEIGHT: 625.78823
SMILES: C[C@@H]1CCC[C@@H]([C@H]1[C@H](C)C(=O)C2=C(OCC2=O)O)/C=C(\CO)/[C@H]3[C@@H](CCC(O3)/C=C/[C@H](C)[C@H]4[C@H](C[C@@H](O4)[C@H](C)OC)C)C.[Na+]
Structure:
CAS RN: 139508-73-9
CAS Name: (1R)-1-[(2S,3S)-3-[(E)-2-[(3S)-3-[(1R)-1-hydroxyethyl]-2-oxiranyl]ethenyl]-2-oxiranyl]-2-propen-1-ol
OPENEYE Name: (1R)-1-[(2S,3S)-3-[(E)-2-[(3S)-3-[(1R)-1-hydroxyethyl]oxiran-2-yl]vinyl]oxiran-2-yl]prop-2-en-1-ol
IUPAC Name: (1R)-1-[(2S,3S)-3-[(E)-2-[(3S)-3-[(1R)-1-hydroxyethyl]oxiran-2-yl]ethenyl]oxiran-2-yl]prop-2-en-1-ol
SYSTEMATIC NAME: (1R)-1-[(2S,3S)-3-[(E)-2-[(3S)-3-[(1R)-1-oxidanylethyl]oxiran-2-yl]ethenyl]oxiran-2-yl]prop-2-en-1-ol
MOLECULAR FORMULA: C11H16O4
MOLECULAR WEIGHT: 212.24234
SMILES: C[C@H]([C@H]1C(O1)/C=C/[C@H]2[C@@H](O2)[C@@H](C=C)O)O
Structure:
CAS RN: 139328-88-4
CAS Name: (5Z,8Z,11Z)-15-hydroxyeicosa-5,8,11-trienoic acid
OPENEYE Name: (5Z,8Z,11Z)-15-hydroxyicosa-5,8,11-trienoic acid
IUPAC Name: (5Z,8Z,11Z)-15-hydroxyicosa-5,8,11-trienoic acid
SYSTEMATIC NAME: (5Z,8Z,11Z)-15-oxidanylicosa-5,8,11-trienoic acid
MOLECULAR FORMULA: C20H34O3
MOLECULAR WEIGHT: 322.48216
SMILES: CCCCCC(CC/C=C\C/C=C\C/C=C\CCCC(=O)O)O
Structure:
CAS RN: 74758-60-4
CAS Name: (11Z,13E)-7,16-diethyl-4,6-dihydroxy-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione
OPENEYE Name: (11Z,13E)-7,16-diethyl-4,6-dihydroxy-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione
IUPAC Name: (11Z,13E)-7,16-diethyl-4,6-dihydroxy-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione
SYSTEMATIC NAME: (11Z,13E)-7,16-diethyl-5,9,13,15-tetramethyl-4,6-bis(oxidanyl)-1-oxacyclohexadeca-11,13-diene-2,10-dione
MOLECULAR FORMULA: C23H38O5
MOLECULAR WEIGHT: 394.54482
SMILES: CCC1CC(C(=O)/C=C\C(=C\C(C(OC(=O)CC(C(C1O)C)O)CC)C)\C)C
Structure:
CAS RN: 74188-23-1
CAS Name: N-[(E)-1-[[12-(3-amino-3-oxopropyl)-3-[3-(diaminomethylideneamino)propyl]-6,21-bis(1-hydroxyethyl)-7,25-dimethyl-18-(2-methylpropyl)-2,5,8,11,14,17,20,23-octaoxo-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-24-yl]amino]-1-oxobut-2-en-2-yl]-3-[[3,4,5-trih
OPENEYE Name: N-[(E)-1-[[12-(3-amino-3-oxo-propyl)-3-(3-guanidinopropyl)-6,21-bis(1-hydroxyethyl)-18-isobutyl-7,25-dimethyl-2,5,8,11,14,17,20,23-octaoxo-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-24-yl]carbamoyl]prop-1-enyl]-3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetr
IUPAC Name: N-[(E)-1-[[12-(3-amino-3-oxopropyl)-3-[3-(diaminomethylideneamino)propyl]-6,21-bis(1-hydroxyethyl)-7,25-dimethyl-18-(2-methylpropyl)-2,5,8,11,14,17,20,23-octaoxo-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-24-yl]amino]-1-oxobut-2-en-2-yl]-3-[3,4,5-trihy
SYSTEMATIC NAME: N-[(E)-1-[[12-(3-azanyl-3-oxidanylidene-propyl)-3-[3-[bis(azanyl)methylideneamino]propyl]-6,21-bis(1-hydroxyethyl)-7,25-dimethyl-18-(2-methylpropyl)-2,5,8,11,14,17,20,23-octakis(oxidanylidene)-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-24-yl]amino]-1-o
MOLECULAR FORMULA: C58H101N13O20
MOLECULAR WEIGHT: 1300.49764
SMILES: CCCCCCCCCCCC(CC(=O)N/C(=C/C)/C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)CNC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC1=O)C(C)O)CC(C)C)CCC(=O)N)C)C(C)O)CCCN=C(N)N)C)OC2C(C(C(C(O2)CO)O)O)O
Structure:
CAS RN: 73942-09-3
CAS Name: (E)-N-[2-[[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-6-[2-[5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]-2-hydroxyethyl]-4,5-dihydroxy-3-oxanyl]-2-pentadecenamide
OPENEYE Name: (E)-N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-2-hydroxy-ethyl]-4,5-dihydroxy-tetrahydropyran-3-yl]pentadec-2-enamide
IUPAC Name: (E)-N-[2-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[2-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl]-4,5-dihydroxyoxan-3-yl]pentadec-2-enamide
SYSTEMATIC NAME: (E)-N-[2-[3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-[2-[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethyl]-4,5-bis(oxidanyl)oxan-3-yl]pentadec-2-enamide
MOLECULAR FORMULA: C38H62N4O16
MOLECULAR WEIGHT: 830.91608
SMILES: CCCCCCCCCCCC/C=C/C(=O)NC1C(C(C(OC1OC2C(C(C(C(O2)CO)O)O)NC(=O)C)CC(C3C(C(C(O3)N4C=CC(=O)NC4=O)O)O)O)O)O
Structure:
CAS RN: 138898-72-3
CAS Name: 4-[[(1R,2R,4aS,5S,8aS)-2-hydroxy-1,4a-dimethyl-6-methylene-5-[(2E)-2-(2-oxo-3-furanylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-4-oxobutanoic acid
OPENEYE Name: 4-[[(1R,2R,4aS,5S,8aS)-2-hydroxy-1,4a-dimethyl-6-methylene-5-[(2E)-2-(2-oxo-3-furylidene)ethyl]decalin-1-yl]methoxy]-4-oxo-butanoic acid
IUPAC Name: 4-[[(1R,2R,4aS,5S,8aS)-2-hydroxy-1,4a-dimethyl-6-methylidene-5-[(2E)-2-(2-oxofuran-3-ylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[[(1R,2R,4aS,5S,8aS)-1,4a-dimethyl-6-methylidene-2-oxidanyl-5-[(2E)-2-(2-oxidanylidenefuran-3-ylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-1-yl]methoxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H32O7
MOLECULAR WEIGHT: 432.50668
SMILES: C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@@H]2C/C=C/3\C=COC3=O)(C)COC(=O)CCC(=O)O)O
Structure:
CAS RN: 138898-71-2
CAS Name: 4-[[(1R,2R,4aS,8aS)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylene-5-[(2E)-2-(2-oxo-3-furanylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl]oxy]-4-oxobutanoic acid
OPENEYE Name: 4-[(1R,2R,4aS,8aS)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylene-5-[(2E)-2-(2-oxo-3-furylidene)ethyl]decalin-2-yl]oxy-4-oxo-butanoic acid
IUPAC Name: 4-[[(1R,2R,4aS,8aS)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylidene-5-[(2E)-2-(2-oxofuran-3-ylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl]oxy]-4-oxobutanoic acid
SYSTEMATIC NAME: 4-[[(1R,2R,4aS,8aS)-1-(hydroxymethyl)-1,4a-dimethyl-6-methylidene-5-[(2E)-2-(2-oxidanylidenefuran-3-ylidene)ethyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl]oxy]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C24H32O7
MOLECULAR WEIGHT: 432.50668
SMILES: C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)C2C/C=C/3\C=COC3=O)(C)CO)OC(=O)CCC(=O)O
Structure:
CAS RN: 138898-70-1
CAS Name: (2R,3R)-2-[(Z)-7-hydroxyhept-2-enyl]-3-[(E,3S)-3-hydroxyoct-1-enyl]-1-cyclopentanone
OPENEYE Name: (2R,3R)-2-[(Z)-7-hydroxyhept-2-enyl]-3-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentanone
IUPAC Name: (2R,3R)-2-[(Z)-7-hydroxyhept-2-enyl]-3-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentan-1-one
SYSTEMATIC NAME: (2R,3R)-2-[(Z)-7-oxidanylhept-2-enyl]-3-[(E,3S)-3-oxidanyloct-1-enyl]cyclopentan-1-one
MOLECULAR FORMULA: C20H34O3
MOLECULAR WEIGHT: 322.48216
SMILES: CCCCC[C@@H](/C=C/[C@H]1CCC(=O)[C@@H]1C/C=C\CCCCO)O
Structure:
CAS RN: 138876-21-8
CAS Name: (2R)-2-amino-3-[[(Z)-3-chloroprop-2-enyl]thio]propanoic acid
OPENEYE Name: (2R)-2-amino-3-[(Z)-3-chloroallyl]sulfanyl-propanoic acid
IUPAC Name: (2R)-2-amino-3-[(Z)-3-chloroprop-2-enyl]sulfanylpropanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-[(Z)-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: 138780-00-4
CAS Name: (E)-1-[fluoro(methyl)phosphoryl]oxy-2-butene
OPENEYE Name: (E)-1-[fluoro(methyl)phosphoryl]oxybut-2-ene
IUPAC Name: (E)-1-[fluoro(methyl)phosphoryl]oxybut-2-ene
SYSTEMATIC NAME: (E)-1-[fluoranyl(methyl)phosphoryl]oxybut-2-ene
MOLECULAR FORMULA: C5H10FO2P
MOLECULAR WEIGHT: 152.103864
SMILES: C/C=C/COP(=O)(C)F
Structure:
CAS RN: 67110-79-6
CAS Name: (Z)-7-[(1S,2R,3R,5S)-2-[[(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]thio]-3,5-dihydroxycyclopentyl]-5-heptenoic acid
OPENEYE Name: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chlorophenoxy)-2-hydroxy-propyl]sulfanyl-3,5-dihydroxy-cyclopentyl]hept-5-enoic acid
IUPAC Name: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]sulfanyl-3,5-dihydroxycyclopentyl]hept-5-enoic acid
SYSTEMATIC NAME: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid
MOLECULAR FORMULA: C21H29ClO6S
MOLECULAR WEIGHT: 444.96936
SMILES: C1[C@@H]([C@@H]([C@H]([C@@H]1O)SC[C@H](COC2=CC(=CC=C2)Cl)O)C/C=C\CCCC(=O)O)O
Structure:
CAS RN: 73523-00-9
CAS Name: (Z)-7-[(1S,2R,3R,5S)-2-[[(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]thio]-3,5-dihydroxycyclopentyl]-5-heptenoic acid
OPENEYE Name: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chlorophenoxy)-2-hydroxy-propyl]sulfanyl-3,5-dihydroxy-cyclopentyl]hept-5-enoic acid
IUPAC Name: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chlorophenoxy)-2-hydroxypropyl]sulfanyl-3,5-dihydroxycyclopentyl]hept-5-enoic acid
SYSTEMATIC NAME: (Z)-7-[(1S,2R,3R,5S)-2-[(2S)-3-(3-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid
MOLECULAR FORMULA: C21H29ClO6S
MOLECULAR WEIGHT: 444.96936
SMILES: C1[C@@H]([C@@H]([C@H]([C@@H]1O)SC[C@H](COC2=CC(=CC=C2)Cl)O)C/C=C\CCCC(=O)O)O
Structure:
CAS RN: 73522-63-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26O6
MOLECULAR WEIGHT: 362.41684
SMILES: C/C=C(/C)\C(=O)O[C@@H]1C[C@@]2([C@H](O2)C[C@@H](/C(=C/[C@@H]3[C@@H]1C(=C)C(=O)O3)/C)O)C
Structure:
CAS RN: 73387-70-9
CAS Name: 1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane; (Z)-4-hydroxy-4-oxo-2-butenoate
OPENEYE Name: 1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane; (Z)-4-hydroxy-4-oxo-but-2-enoate
IUPAC Name: 1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane; (Z)-4-hydroxy-4-oxobut-2-enoate
SYSTEMATIC NAME: 1,4-bis(2-chloroethyl)-1,4-diazoniabicyclo[2.2.1]heptane; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate
MOLECULAR FORMULA: C17H24Cl2N2O8
MOLECULAR WEIGHT: 455.28706
SMILES: C1[N+]2(C[N+](C1)(CC2)CCCl)CCCl.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O
Structure:
CAS RN: 73341-71-6
CAS Name: (E,2E,3S,4S)-4-methoxy-2-(methoxymethylidene)-3-methyl-6-phenyl-5-hexenoic acid methyl ester
OPENEYE Name: methyl (E,2E,3S,4S)-4-methoxy-2-(methoxymethylene)-3-methyl-6-phenyl-hex-5-enoate
IUPAC Name: methyl (E,2E,3S,4S)-4-methoxy-2-(methoxymethylidene)-3-methyl-6-phenylhex-5-enoate
SYSTEMATIC NAME: methyl (E,2E,3S,4S)-4-methoxy-2-(methoxymethylidene)-3-methyl-6-phenyl-hex-5-enoate
MOLECULAR FORMULA: C17H22O4
MOLECULAR WEIGHT: 290.35418
SMILES: C[C@H]([C@H](/C=C/C1=CC=CC=C1)OC)/C(=C\OC)/C(=O)OC
Structure:
CAS RN: 71953-80-5
CAS Name: (E)-7-[4,6-dihydroxy-2-[(1E,5E)-3-hydroxyocta-1,5-dienyl]-3-oxanyl]-5-heptenoic acid
OPENEYE Name: (E)-7-[4,6-dihydroxy-2-[(1E,5E)-3-hydroxyocta-1,5-dienyl]tetrahydropyran-3-yl]hept-5-enoic acid
IUPAC Name: (E)-7-[4,6-dihydroxy-2-[(1E,5E)-3-hydroxyocta-1,5-dienyl]oxan-3-yl]hept-5-enoic acid
SYSTEMATIC NAME: (E)-7-[4,6-bis(oxidanyl)-2-[(1E,5E)-3-oxidanylocta-1,5-dienyl]oxan-3-yl]hept-5-enoic acid
MOLECULAR FORMULA: C20H32O6
MOLECULAR WEIGHT: 368.46448
SMILES: CC/C=C/CC(/C=C/C1C(C(CC(O1)O)O)C/C=C/CCCC(=O)O)O
Structure:
CAS RN: 71933-54-5
CAS Name: (Z)-2-(hydroxymethyl)-4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-butenenitrile
OPENEYE Name: (Z)-2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-but-2-enenitrile
IUPAC Name: (Z)-2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-but-2-enenitrile
MOLECULAR FORMULA: C11H17NO7
MOLECULAR WEIGHT: 275.25518
SMILES: C(/C=C(\CO)/C#N)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Structure:
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