Himeic acid D (CHEBI:182193)

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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	Himeic acid D

ChEBI ID	CHEBI:182193

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H24N2O4

Net Charge

Average Mass

320.389

Monoisotopic Mass

320.17361

InChI

InChI=1S/C17H24N2O4/c18-17(23)14-12-19-13(11-15(14)20)9-7-5-3-1-2-4-6-8-10-16(21)22/h7,9,11-12H,1-6,8,10H2,(H2,18,23)(H,19,20)(H,21,22)/b9-7+

InChIKey

FQHXRDDMWDQLPV-VQHVLOKHSA-N

SMILES

OC(=O)CCCCCCCC/C=C/C=1NC=C(C(=O)C1)C(=O)N

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Himeic acid D (CHEBI:182193) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(E)-11-(5-carbamoyl-4-oxo-1H-pyridin-2-yl)undec-10-enoic acid