CHEBI:204044 - 1-O-acetyl hygrophorone E12

ChEBI IDCHEBI:204044
ChEBI Name1-O-acetyl hygrophorone E12
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H34O5
Net Charge0
Average Mass354.487
Monoisotopic Mass354.24062
SMILESCCCCCCCCCCCCC(=O)[C@@]1(O)C(OC(C)=O)C=C[C@H]1O
InChIInChI=1S/C20H34O5/c1-3-4-5-6-7-8-9-10-11-12-13-17(22)20(24)18(23)14-15-19(20)25-16(2)21/h14-15,18-19,23-24H,3-13H2,1-2H3/t18-,19?,20+/m1/s1
InChIKeyLIUJFRRXKUPNPQ-ITIDOPETSA-N
Species of MetaboliteComponentSourceComments
Hygrophorus persoonii (ncbitaxon:1032769) - PubMed (15110686)
ChEBI Ontology
Outgoing Relation(s)
1-O-acetyl hygrophorone E12 (CHEBI:204044) is a ketone (CHEBI:17087)
IUPAC Name 
[(4R,5S)-4,5-dihydroxy-5-tridecanoylcyclopent-2-en-1-yl] acetate
Manual XrefsDatabases
9625935ChemSpider