CHEBI:223105 - Pyrenophoric acid B

ChEBI IDCHEBI:223105
ChEBI NamePyrenophoric acid B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O4
Net Charge0
Average Mass268.353
Monoisotopic Mass268.16746
SMILESCC(=C/C(=O)O)/C=C/[C@]1(O)[C@H](C)C[C@@H](O)CC1(C)C
InChIInChI=1S/C15H24O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-7,11-12,16,19H,8-9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t11-,12-,15+/m1/s1
InChIKeyXABKJZWWYZHMSK-UXIJHLSFSA-N
Species of MetaboliteComponentSourceComments
Pyrenophora seminiperda (ncbitaxon:91370) - PubMed (25264583)
ChEBI Ontology
Outgoing Relation(s)
Pyrenophoric acid B (CHEBI:223105) is a apo carotenoid sesquiterpenoid (CHEBI:36758)
IUPAC Name 
(2Z,4E)-5-[(1R,4R,6R)-1,4-dihydroxy-2,2,6-trimethylcyclohexyl]-3-methylpenta-2,4-dienoic acid
Manual XrefsDatabases
78437715ChemSpider