Details of Agathalic acid
| IUPAC | (E)-5-[(1R,4aR,5S,8aR)-5-formyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoic acid |
| Canonical Smiles | C/C(=CC(=O)O)/CC[C@@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(C)C=O)C |
| Inchi | SNMGJTHIWYSOSX-YNLIENTKSA-N |
| PubChem ID | 101297697 |
| Smiles | C=C1CC[C@H]2[C@@](C)(C=O)CCC[C@]2(C)[C@@H]1CC=C(C)CC(=O)O |
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| Class | Labdane diterpenoids, Norlabdane diterpenoids |
| Super Class | Diterpenoids |
| Pathways | Terpenoids |
