Himeic acid B (CHEBI:200734)

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CHEBI:200734 - Himeic acid B

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ChEBI ID	CHEBI:200734
ChEBI Name	Himeic acid B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C17H23NO5
Net Charge	0
Average Mass	321.373
Monoisotopic Mass	321.15762
SMILES	NC(=O)c1coc(/C=C/CCCCCCCCC(=O)O)cc1=O
InChI	InChI=1S/C17H23NO5/c18-17(22)14-12-23-13(11-15(14)19)9-7-5-3-1-2-4-6-8-10-16(20)21/h7,9,11-12H,1-6,8,10H2,(H2,18,22)(H,20,21)/b9-7+
InChIKey	CFCNZKAZHHLTLD-VQHVLOKHSA-N

Species of Metabolite	Component	Source	Comments
Aspergillusspecies (ncbitaxon:5065)	-	PubMed (15582438)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Himeic acid B (CHEBI:200734) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(E)-11-(5-carbamoyl-4-oxopyran-2-yl)undec-10-enoic acid

Manual Xrefs	Databases
10191862	ChemSpider