Communic acid, (E)-
(1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Also Known As: Communic Acid|trans-Communic acid|Communinic acid|cis-Communic acid|Communic acid, (E)-|(+)-Communic acid|trans-Cummunic acid|(-)-Communic acid|trans-Communinic acid|(12E)-Communic acid|Communic acid, (+)-(E)-|HY-N3612A|HY-N3612|TN3691|FS-9702|2-hydroxy-3-(trifluoromethoxy)benzaldehyde|Labda-8(20),12,14-trien-19-oic acid, (E)-|8(20),12,14-Labdatriene-19-oic acid|Labda-8(20),12,14-triene-19-oic acid|(12E)-Labda-8(20),12,14-trien-19-oic acid|(1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid|(1S,4aR,5S,8aR)-Decahydro-1,4a-dimethyl-6-methylene-5-((2E)-3-methyl-2,4-pentadien-1-yl)-1-naphthalenecarboxylic acid|1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-((2E)-3-methyl-2,4-pentadien-1-yl)-, (1S,4aR,5S,8aR)-|1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-2,4-pentadienyl)-, (1S,4aR,5S,8aR)-|(1S,4aalpha)-Decahydro-1beta-(3-methyl-2,4-pentadienyl)-2-methylene-5,8abeta-dimethylnaphthalene-5beta-carboxylic acid|(1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-((2E)-3-methylpenta-2,4-dienyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid|(1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-(3-methylpenta-2,4-dien-1-yl)-decahydronaphthalene-1-carboxylic acid|(1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dien-1-yl]-decahydronaphthalene-1-carboxylic acid
| Molecular Formula | C20H30O2 |
|---|---|
| Molecular Weight | 302.22458 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.22458 |
| Monoisotopic Mass | 302.22458 |
| Heavy Atoms | 22 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 1231-35-2 |
|---|---|
| SMILES | C/C(=C\C[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)C(=O)O)C)/C=C |
| InChIKey | YGBZFOQXPOGACY-VWVSFFKRSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Communic acid, (E)- (CAS 1231-35-2), with molecular formula C20H30O2 and molecular weight 302.22458 g/mol. IUPAC: (1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid.
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