CHEBI:200358 - 4,5,6-Tri-O-acetyl hygrophorone B14

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 4,5,6-Tri-O-acetyl hygrophorone B14
ChEBI ID CHEBI:200358
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H42O7
Net Charge 0
Average Mass 466.615
Monoisotopic Mass 466.29305
InChI InChI=1S/C26H42O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31-20(2)27)26(33-22(4)29)23(30)18-19-25(26)32-21(3)28/h18-19,24-25H,5-17H2,1-4H3/t24?,25-,26-/m0/s1
InChIKey SLRHSNRHCRDZAO-WIXBZOCESA-N
SMILES O=C1C=C[C@@H]([C@@]1(OC(=O)C)C(OC(=O)C)CCCCCCCCCCCCCC)OC(=O)C
Metabolite of Species Details
Hygrophorus latitabundus (NCBI:txid131569) See: PubMed
ChEBI Ontology
Outgoing 4,5,6-Tri-O-acetyl hygrophorone B14 (CHEBI:200358) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(1S,5S)-5-acetyloxy-5-(1-acetyloxypentadecyl)-4-oxocyclopent-2-en-1-yl] acetate
Manual Xref Database
9446291 ChemSpider
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