Pyrenophoric acid B (CHEBI:223105)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Pyrenophoric acid B

ChEBI ID	CHEBI:223105

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

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Formula

C15H24O4

Net Charge

Average Mass

268.353

Monoisotopic Mass

268.16746

InChI

InChI=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

InChIKey

XABKJZWWYZHMSK-UXIJHLSFSA-N

SMILES

O=C(O)/C=C(\C=C\[C@@]1(O)C(C[C@H](O)C[C@H]1C)(C)C)/C

Metabolite of Species	Details
Pyrenophora seminiperda (NCBI:txid91370)	See: PubMed

ChEBI Ontology
Outgoing	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