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CHEBI:217020 - Botryotin D
| Formula | C20H32O4 |
| Net Charge | 0 |
| Average Mass | 336.472 |
| Monoisotopic Mass | 336.23006 |
| SMILES | C[C@@]1(CO)[C@H](O)CC[C@]2(C)C3=C[C@H]4[C@@H](O)[C@]3(CC[C@@H]12)CC[C@@]4(C)O |
| InChI | InChI=1S/C20H32O4/c1-17-6-5-15(22)18(2,11-21)13(17)4-7-20-9-8-19(3,24)12(16(20)23)10-14(17)20/h10,12-13,15-16,21-24H,4-9,11H2,1-3H3/t12-,13+,15+,16+,17-,18-,19+,20+/m0/s1 |
| InChIKey | TZQBGPHSFRWTRR-WURLERGCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Botrytis cinerea (ncbitaxon:40559) | - | PubMed (31880464) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Botryotin D (CHEBI:217020) is a tertiary alcohol (CHEBI:26878) |
| IUPAC Name |
|---|
| (1R,4R,5R,6R,9S,12S,13R,16R)-5-(hydroxymethyl)-5,9,13-trimethyltetracyclo[10.3.1.01,10.04,9]hexadec-10-ene-6,13,16-triol |
| Manual Xrefs | Databases |
|---|---|
| 81363750 | ChemSpider |