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CHEBI:206760 - Poricoic acid J
| Formula | C31H46O7 |
| Net Charge | 0 |
| Average Mass | 530.702 |
| Monoisotopic Mass | 530.32435 |
| SMILES | C=C(C)[C@@H]1CC=C2C(=CC[C@]3(C)[C@@H]([C@@H](CC/C(CO)=C(\C)CO)C(=O)O)[C@H](O)C[C@@]23C)[C@@]1(C)CCC(=O)O |
| InChI | InChI=1S/C31H46O7/c1-18(2)22-9-10-24-23(29(22,4)13-12-26(35)36)11-14-30(5)27(25(34)15-31(24,30)6)21(28(37)38)8-7-20(17-33)19(3)16-32/h10-11,21-22,25,27,32-34H,1,7-9,12-17H2,2-6H3,(H,35,36)(H,37,38)/b20-19-/t21-,22+,25-,27+,29+,30-,31+/m1/s1 |
| InChIKey | IZZSRMHCEIYKAE-JDSTXSGKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Wolfiporia cocos (ncbitaxon:81056) | - | PubMed (31180673) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Poricoic acid J (CHEBI:206760) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (Z,2R)-2-[(2R,3R,3aR,6S,7S,9bR)-6-(2-carboxyethyl)-2-hydroxy-3a,6,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-7-hydroxy-5-(hydroxymethyl)-6-methylhept-5-enoic acid |