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CHEBI:210694 - Dihydroxyneogrifolic acid
| Formula | C23H34O6 |
| Net Charge | 0 |
| Average Mass | 406.519 |
| Monoisotopic Mass | 406.23554 |
| SMILES | C/C(=C\Cc1c(O)cc(O)c(C(=O)O)c1C)CC/C=C(\C)CC[C@H](O)C(C)(C)O |
| InChI | InChI=1S/C23H34O6/c1-14(7-6-8-15(2)10-12-20(26)23(4,5)29)9-11-17-16(3)21(22(27)28)19(25)13-18(17)24/h8-9,13,20,24-26,29H,6-7,10-12H2,1-5H3,(H,27,28)/b14-9+,15-8+/t20-/m0/s1 |
| InChIKey | PLQYDIDGVVEJIJ-UZFXXOKOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Penicilliumspecies T2-8 (ncbitaxon:1833940) | - | DOI (10.1016/j.phytol.2016.10.013) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dihydroxyneogrifolic acid (CHEBI:210694) is a sesquiterpenoid (CHEBI:26658) |
| IUPAC Name |
|---|
| 3-[(2E,6E,10S)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienyl]-4,6-dihydroxy-2-methylbenzoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78442074 | ChemSpider |