Details of ALPHITOLIC-ACID
| IUPAC | (1R,3aS,5aR,5bR,7aR,9R,10R,11aR,11bR,13aR,13bR)-9,10-dihydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid |
| Canonical Smiles | CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O |
| Inchi | PFCVZKFJHRCLCC-PGOIBATFSA-N |
| PubChem ID | 12305768 |
| Smiles | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C12 |
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| Class | Dibenzylbutane lignans |
| Super Class | Lignans |
| Pathways | Shikimates and Phenylpropanoids |
