Acetylcarnosine (CHEBI:172509)

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CHEBI:172509 - Acetylcarnosine

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ChEBI ID	CHEBI:172509
ChEBI Name	Acetylcarnosine
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C11H16N4O4
Net Charge	0
Average Mass	268.273
Monoisotopic Mass	268.11715
SMILES	CC(=O)NCCC(=O)N[C@H](Cc1cncn1)C(=O)O
InChI	InChI=1S/C11H16N4O4/c1-7(16)13-3-2-10(17)15-9(11(18)19)4-8-5-12-6-14-8/h5-6,9H,2-4H2,1H3,(H,12,14)(H,13,16)(H,15,17)(H,18,19)/t9-/m1/s1
InChIKey	BKAYIFDRRZZKNF-SECBINFHSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	blood plasma (BTO:0000131)	MetaboLights (MTBLS2633)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Acetylcarnosine (CHEBI:172509) is a peptide (CHEBI:16670)

IUPAC Name
(2R)-2-(3-acetamidopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acid

Manual Xrefs	Databases
8396518	ChemSpider
HMDB0012881	HMDB