Details of Scoparic acid
| IUPAC | (1R)-8-benzoyloxy-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid |
| Canonical Smiles | CC(=CCO)CCC1C(=C)CC(C2C1(CCCC2(C)C(=O)O)C)OC(=O)C3=CC=CC=C3 |
| Inchi | GIQOHSBJFWWSAH-QFMUUKLNSA-N |
| PubChem ID | 101616639 |
| Smiles | C=C1CC(OC(=O)c2ccccc2)C2C(C)(C(=O)O)CCCC2(C)C1CCC(C)=CCO |
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