N2-Acetyl-L-glutaminyl-L-glutamamide (CHEBI:177714)

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CHEBI:177714 - N2-Acetyl-L-glutaminyl-L-glutamamide

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ChEBI ID	CHEBI:177714
ChEBI Name	N2-Acetyl-L-glutaminyl-L-glutamamide
Stars
Last Modified	10 September 2021
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H21N5O5
Net Charge	0
Average Mass	315.330
Monoisotopic Mass	315.15427
SMILES	CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O
InChI	InChI=1S/C12H21N5O5/c1-6(18)16-8(3-5-10(14)20)12(22)17-7(11(15)21)2-4-9(13)19/h7-8H,2-5H2,1H3,(H2,13,19)(H2,14,20)(H2,15,21)(H,16,18)(H,17,22)/t7-,8-/m0/s1
InChIKey	KLQXKYZBJWERSF-YUMQZZPRSA-N

Species of Metabolite	Component	Source	Comments
Sus scrofa (ncbitaxon:9823)	sausage (ENVO:00002166)	MetaboLights (MTBLS2871)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	N2-Acetyl-L-glutaminyl-L-glutamamide (CHEBI:177714) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-2-[[(2S)-2-acetamido-5-amino-5-oxopentanoyl]amino]pentanediamide

Manual Xrefs	Databases
114998	ChemSpider

Registry Numbers	Sources
CAS:123199-99-5	ChemIDplus