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CHEBI:224975 - Aphidicolin A60
| Formula | C20H28O5 |
| Net Charge | 0 |
| Average Mass | 348.439 |
| Monoisotopic Mass | 348.19367 |
| SMILES | C[C@]12COC3=C1[C@](C)(CC[C@H]2O)[C@]12CC[C@](O)(C(=O)O)[C@H](C[C@@H]1C3)C2 |
| InChI | InChI=1S/C20H28O5/c1-17-10-25-13-8-11-7-12-9-19(11,5-6-20(12,24)16(22)23)18(2,15(13)17)4-3-14(17)21/h11-12,14,21,24H,3-10H2,1-2H3,(H,22,23)/t11-,12-,14-,17-,18+,19+,20-/m1/s1 |
| InChIKey | MFUFYVRSGKJJNS-DEWXCMOMSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Botryotinia (ncbitaxon:40558) | - | PubMed (31403790) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Aphidicolin A60 (CHEBI:224975) is a sesquiterpenoid (CHEBI:26658) |
| IUPAC Name |
|---|
| (1R,2S,5R,6R,8R,13R,14R)-5,14-dihydroxy-1,13-dimethyl-11-oxapentacyclo[8.6.1.12,6.02,8.013,17]octadec-10(17)-ene-5-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 78966227 | ChemSpider |