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CHEBI:172758 - Hericene B
| Formula | C37H58O5 |
| Net Charge | 0 |
| Average Mass | 582.866 |
| Monoisotopic Mass | 582.42842 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCc1cc(OC)c(C/C=C(\C)CCC=C(C)C)c(O)c1C=O |
| InChI | InChI=1S/C37H58O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-36(39)42-29-32-27-35(41-5)33(37(40)34(32)28-38)26-25-31(4)23-21-22-30(2)3/h13-14,22,25,27-28,40H,6-12,15-21,23-24,26,29H2,1-5H3/b14-13-,31-25+ |
| InChIKey | UJSYMVCGDZCLIO-LTBKHPPLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2633) | |
| Hericium erinaceus (ncbitaxon:91752) | - | DOI (10.1021/np50107a006) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Hericene B (CHEBI:172758) is a monoterpenoid (CHEBI:25409) |
| IUPAC Names |
|---|
| [4-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-ormyl-3-hydroxy-5-methoxyphenyl]methyl (Z)-octadec-9-enoate |
| [4-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-hydroxy-2-(hydroxymethyl)-5-methoxyphenyl]methyl (E)-octadec-9-enoate |