Acetylcarnosine (CHEBI:172509)

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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	Acetylcarnosine

ChEBI ID	CHEBI:172509

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H16N4O4

Net Charge

Average Mass

268.273

Monoisotopic Mass

268.11716

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

SMILES

OC(=O)[C@H](NC(=O)CCNC(=O)C)CC=1NC=NC1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

ChEBI Ontology
Outgoing	Acetylcarnosine (CHEBI:172509) is a peptide (CHEBI:16670)

IUPAC Name

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