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CHEBI:212842 - Erinacerin O
| Formula | C19H28N2O6 |
| Net Charge | 0 |
| Average Mass | 380.441 |
| Monoisotopic Mass | 380.19474 |
| SMILES | CCC(C)[C@H](O)C(=N[C@H](C(C)C)n1cc(C(C)=O)c(=O)cc1CO)C(=O)O |
| InChI | InChI=1S/C19H28N2O6/c1-6-11(4)17(25)16(19(26)27)20-18(10(2)3)21-8-14(12(5)23)15(24)7-13(21)9-22/h7-8,10-11,17-18,22,25H,6,9H2,1-5H3,(H,26,27)/t11?,17-,18-/m0/s1 |
| InChIKey | XELPLZCCFQVOFX-AZOLZQDUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Hericium erinaceus (ncbitaxon:91752) | - | DOI (10.1016/j.tet.2015.10.068) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Erinacerin O (CHEBI:212842) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| (3S)-2-[(1R)-1-[5-acetyl-2-(hydroxymethyl)-4-oxopyridin-1-yl]-2-methylpropyl]imino-3-hydroxy-4-methylhexanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78438554 | ChemSpider |