CHEBI:207773 - Hygrophorone A12

ChEBI IDCHEBI:207773
ChEBI NameHygrophorone A12
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCCCCCCCCCC(O)[C@]1(O)C(=O)C=C[C@@H]1O
InChIInChI=1S/C18H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-15(19)18(22)16(20)13-14-17(18)21/h13-16,19-20,22H,2-12H2,1H3/t15?,16-,18+/m0/s1
InChIKeyBBWLIRJDGKYFLE-BSRYDQRCSA-N
Species of MetaboliteComponentSourceComments
Hygrophorus persoonii (ncbitaxon:1032769) - PubMed (15110686)
ChEBI Ontology
Outgoing Relation(s)
Hygrophorone A12 (CHEBI:207773) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
(4S,5R)-4,5-dihydroxy-5-(1-hydroxytridecyl)cyclopent-2-en-1-one
Manual XrefsDatabases
78438433ChemSpider