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CHEBI:207075 - Geniculol

ChEBI IDCHEBI:207075
ChEBI NameGeniculol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O6
Net Charge0
Average Mass362.422
Monoisotopic Mass362.17294
SMILESC[C@]12CCC(=O)O[C@H]1C1=C[C@H]3OC(=O)[C@@]4(C)CCC[C@@](C)([C@@H]34)[C@]1(O)[C@H]2O
InChIInChI=1S/C20H26O6/c1-17-6-4-7-19(3)13(17)11(25-16(17)23)9-10-14-18(2,8-5-12(21)26-14)15(22)20(10,19)24/h9,11,13-15,22,24H,4-8H2,1-3H3/t11-,13+,14+,15+,17+,18+,19+,20-/m1/s1
InChIKeyJMAPMWNXFJANPJ-OTLMSYBKSA-N
Species of MetaboliteComponentSourceComments
Geniculosporium (ncbitaxon:1479502) - PubMed (9917307)
ChEBI Ontology
Outgoing Relation(s)
Geniculol (CHEBI:207075) is a δ-lactone (CHEBI:18946)
IUPAC Name 
(1S,2R,3S,4R,9R,12R,15S,19R)-2,3-dihydroxy-1,4,15-trimethyl-8,13-dioxapentacyclo[10.6.1.02,10.04,9.015,19]nonadec-10-ene-7,14-dione
Manual XrefsDatabases
8889008ChemSpider