CHEBI:69276 - aphidicolin-17-monoacetate

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ChEBI Name aphidicolin-17-monoacetate
ChEBI ID CHEBI:69276
Definition A natural product found in Tolypocladium inflatum.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H36O5
Net Charge 0
Average Mass 380.51820
Monoisotopic Mass 380.25627
InChI InChI=1S/C22H36O5/c1-14(24)27-13-22(26)9-8-21-11-16(22)10-15(21)4-5-17-19(2,12-23)18(25)6-7-20(17,21)3/h15-18,23,25-26H,4-13H2,1-3H3/t15-,16+,17-,18+,19-,20-,21-,22-/m0/s1
InChIKey GAPINCSXTLCIPV-BORIEPGUSA-N
SMILES [H][C@@]12CC[C@@]3([H])[C@](C)(CO)[C@H](O)CC[C@]3(C)[C@]11CC[C@](O)(COC(C)=O)[C@]([H])(C2)C1
Metabolite of Species Details
Tolypocladium inflatum (NCBI:txid29910) Ethylacetate extract and fungus isolated from a soilsample on fruiting body of Cordyceps sinensis See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing aphidicolin-17-monoacetate (CHEBI:69276) has role metabolite (CHEBI:25212)
aphidicolin-17-monoacetate (CHEBI:69276) is a diterpenoid (CHEBI:23849)
Synonym Source
[(2S,5R,6R,7R,10S,12R,13S)-5,13-Dihydroxy-6-(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.0[1,10].0[2,7]]hexadec-13-yl]methyl acetate ChEBI
Manual Xref Database
0051103572 ChemIDplus
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Citation Waiting for Citations Type Source
21812410 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:tertiary alcohol(CHEBI:26878); ISA:secondary alcohol(CHEBI:35681); ISA:carboxylic ester(CHEBI:33308); ISA:organic hydroxy compound(CHEBI:33822); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:primary alcohol(CHEBI:15734); ISA:carbonyl compound(CHEBI:36586);