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CHEBI:216586 - Phellinulin I

ChEBI IDCHEBI:216586
ChEBI NamePhellinulin I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O4
Net Charge0
Average Mass268.353
Monoisotopic Mass268.16746
SMILESCC(C=C[C@@H]1C(C)(C)CCC[C@@]1(O)CO)=CC(=O)O
InChIInChI=1S/C15H24O4/c1-11(9-13(17)18)5-6-12-14(2,3)7-4-8-15(12,19)10-16/h5-6,9,12,16,19H,4,7-8,10H2,1-3H3,(H,17,18)/t12-,15-/m1/s1
InChIKeyCPCPGWKAUSNIIR-IUODEOHRSA-N
Species of MetaboliteComponentSourceComments
Tropicoporus linteus (ncbitaxon:1659895) - PubMed (30002357)
ChEBI Ontology
Outgoing Relation(s)
Phellinulin I (CHEBI:216586) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-[(1R,2S)-2-hydroxy-2-(hydroxymethyl)-6,6-dimethylcyclohexyl]-3-methylpenta-2,4-dienoic acid