EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H38O8 |
| Net Charge | 0 |
| Average Mass | 490.593 |
| Monoisotopic Mass | 490.25667 |
| SMILES | CC(CCC(=O)O)C1CC(=O)C2(C)C3=C(C(=O)C(O)C12C)C1(C)CCC(O)C(C)(CO)C1CC3=O |
| InChI | InChI=1S/C27H38O8/c1-13(6-7-19(32)33)14-10-18(31)27(5)20-15(29)11-16-24(2,9-8-17(30)25(16,3)12-28)21(20)22(34)23(35)26(14,27)4/h13-14,16-17,23,28,30,35H,6-12H2,1-5H3,(H,32,33) |
| InChIKey | HAVMVUFJSIMVDG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cryptomeria (ncbitaxon:3368) | needle (BTO:0000917) | MetaboLights (MTBLS4099) | Strain: Cryptomeria fortunei Hooibrenk |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lucidenic acid J (CHEBI:192868) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| 4-[3,12-dihydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0035700 | HMDB |