Details of Morellic acid
| IUPAC | 4-[12-hydroxy-8,8,21,21-tetramethyl-5-(3-methylbut-2-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid |
| Canonical Smiles | CC(=CCC1=C2C(=C(C3=C1OC45C6CC(C=C4C3=O)C(=O)C5(OC6(C)C)CC=C(C)C(=O)O)O)C=CC(O2)(C)C)C |
| Inchi | COVMVPHACFXMAX-UHFFFAOYSA-N |
| PubChem ID | 550587 |
| Smiles | CC(C)=CCc1c2c(c(O)c3c1OC14C(=CC5CC1C(C)(C)OC4(C=CC(C)C(=O)O)C5=O)C3=O)C=CC(C)(C)O2 |
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| Class | Plant xanthones |
| Super Class | Xanthones |
| Pathways | Shikimates and Phenylpropanoids |
