anserine zwitterion (CHEBI:58445)

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ChEBI Name	anserine zwitterion

ChEBI ID	CHEBI:58445

Definition	Zwitterionic form of anserine.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C10H16N4O3

Net Charge

Average Mass

240.25900

Monoisotopic Mass

240.12224

InChI

InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)/t8-/m0/s1

InChIKey

MYYIAHXIVFADCU-QMMMGPOBSA-N

SMILES

Cn1cncc1C[C@H](NC(=O)CC[NH3+])C([O-])=O

Roles Classification
Biological Role(s):	animal metabolite Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.

ChEBI Ontology
Outgoing	anserine zwitterion (CHEBI:58445) has role animal metabolite (CHEBI:75767) anserine zwitterion (CHEBI:58445) is a zwitterion (CHEBI:27369) anserine zwitterion (CHEBI:58445) is tautomer of anserine (CHEBI:18323)

Incoming	anserine (CHEBI:18323) is tautomer of anserine zwitterion (CHEBI:58445)

IUPAC Name

(2S)-2-[(3-ammoniopropanoyl)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoate

Synonym	Source
anserine	UniProt

Last Modified

18 February 2015