EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:217667 - Erinacerin H
| Formula | C16H19NO5 |
| Net Charge | 0 |
| Average Mass | 305.330 |
| Monoisotopic Mass | 305.12632 |
| SMILES | COC(=O)C/C=C(\C)CCc1c(O)cc2c(c1O)CNC2=O |
| InChI | InChI=1S/C16H19NO5/c1-9(4-6-14(19)22-2)3-5-10-13(18)7-11-12(15(10)20)8-17-16(11)21/h4,7,18,20H,3,5-6,8H2,1-2H3,(H,17,21)/b9-4+ |
| InChIKey | RSFYAKQDIQNAET-RUDMXATFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Hericium erinaceus (ncbitaxon:91752) | - | PubMed (25565282) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Erinacerin H (CHEBI:217667) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| methyl (E)-6-(4,6-dihydroxy-1-oxo-2,3-dihydroisoindol-5-yl)-4-methylhex-3-enoate |
| Manual Xrefs | Databases |
|---|---|
| 58968117 | ChemSpider |