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CHEBI:219934 - 15-Hydroxy-3-epiisopetasol

ChEBI IDCHEBI:219934
ChEBI Name15-Hydroxy-3-epiisopetasol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC(C)=C1C[C@@]2(C)C(=CC1=O)CC[C@H](O)[C@@H]2CO
InChIInChI=1S/C15H22O3/c1-9(2)11-7-15(3)10(6-14(11)18)4-5-13(17)12(15)8-16/h6,12-13,16-17H,4-5,7-8H2,1-3H3/t12-,13-,15-/m0/s1
InChIKeyAIXQTGFSNZUXLM-YDHLFZDLSA-N
ChEBI Ontology
Outgoing Relation(s)
15-Hydroxy-3-epiisopetasol (CHEBI:219934) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4aR,5S,6S)-6-hydroxy-5-(hydroxymethyl)-4a-methyl-3-propan-2-ylidene-5,6,7,8-tetrahydro-4H-naphthalen-2-one
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