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CHEBI:217854 - Kandenol A

ChEBI IDCHEBI:217854
ChEBI NameKandenol A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC1=CC(=O)C[C@]2(C)C[C@@H](O)[C@H](C(C)(C)O)C[C@@H]12
InChIInChI=1S/C15H24O3/c1-9-5-10(16)7-15(4)8-13(17)12(6-11(9)15)14(2,3)18/h5,11-13,17-18H,6-8H2,1-4H3/t11-,12+,13+,15+/m0/s1
InChIKeyMEPRCLDIBSGQBP-KYEXWDHISA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (23234344)
ChEBI Ontology
Outgoing Relation(s)
Kandenol A (CHEBI:217854) is a eudesmane sesquiterpenoid (CHEBI:62508)
IUPAC Name 
(4aR,6R,7R,8aS)-7-hydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-1,4a,5,6,7,8-hexahydronaphthalen-2-one
Manual XrefsDatabases
28536071ChemSpider