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CHEBI:224797 - Aphidicolin A28
| Formula | C22H34O6 |
| Net Charge | 0 |
| Average Mass | 394.508 |
| Monoisotopic Mass | 394.23554 |
| SMILES | CC(=O)OC[C@@]1(O)C[C@H](O)[C@]23C[C@H]1C=C2CC[C@H]1[C@](C)(CO)[C@H](O)CC[C@@]13C |
| InChI | InChI=1S/C22H34O6/c1-13(24)28-12-21(27)10-18(26)22-9-15(21)8-14(22)4-5-16-19(2,11-23)17(25)6-7-20(16,22)3/h8,15-18,23,25-27H,4-7,9-12H2,1-3H3/t15-,16+,17-,18+,19+,20+,21+,22+/m1/s1 |
| InChIKey | AZLDLRVUUKNDKW-KCTWHOTLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Botryotinia (ncbitaxon:40558) | - | PubMed (31403790) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Aphidicolin A28 (CHEBI:224797) is a diterpenoid (CHEBI:23849) |
| IUPAC Name |
|---|
| [(1R,2S,5R,6R,7R,12S,13R,15S)-5,13,15-trihydroxy-6-(hydroxymethyl)-2,6-dimethyl-13-tetracyclo[10.3.1.01,10.02,7]hexadec-10-enyl]methyl acetate |
| Manual Xrefs | Databases |
|---|---|
| 78966195 | ChemSpider |