CHEBI:203356 - Phellinene acid B

ChEBI IDCHEBI:203356
ChEBI NamePhellinene acid B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESC=C1C[C@@H](O)CC(C)(C)[C@@H]1CCC(C)CC(=O)O
InChIInChI=1S/C15H26O3/c1-10(7-14(17)18)5-6-13-11(2)8-12(16)9-15(13,3)4/h10,12-13,16H,2,5-9H2,1,3-4H3,(H,17,18)/t10?,12-,13-/m1/s1
InChIKeyYPPJUADKLHXSSV-SKVSWLLESA-N
Species of MetaboliteComponentSourceComments
Phellinus (ncbitaxon:40470) - PubMed (22574939)
ChEBI Ontology
Outgoing Relation(s)
Phellinene acid B (CHEBI:203356) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-[(1S,4S)-4-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl]-3-methylpentanoic acid
Manual XrefsDatabases
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