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CHEBI:184491 - Sundiversifolide

ChEBI IDCHEBI:184491
ChEBI NameSundiversifolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22O3
Net Charge0
Average Mass238.327
Monoisotopic Mass238.15689
SMILES[H][C@@]12C[C@H](C)C(CCCO)=CC[C@]1([H])[C@H](C)C(=O)O2
InChIInChI=1S/C14H22O3/c1-9-8-13-12(10(2)14(16)17-13)6-5-11(9)4-3-7-15/h5,9-10,12-13,15H,3-4,6-8H2,1-2H3/t9-,10-,12+,13+/m0/s1
InChIKeyOXNJNKIMPIRBQC-YRRQLQLVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Sundiversifolide (CHEBI:184491) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(3S,3aR,7S,8aR)-6-(3-hydroxypropyl)-3,7-dimethyl-3,3a,4,7,8,8a-hexahydrocyclohepta[b]uran-2-one
Manual XrefsDatabases
24846707ChemSpider