2-[(2-aminoethylcarbamoyl)methyl]-2-hydroxybutanedioate (CHEBI:142970)

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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	2-[(2-aminoethylcarbamoyl)methyl]-2-hydroxybutanedioate

ChEBI ID	CHEBI:142970

Definition	The stereoconfiguration is based on CHEBI:134612, pmid:20810662

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

Submitter	Kristian Axelsen

Supplier Information	ChemicalBook:CB6344397, ChemicalBook:CB4120553, eMolecules:30152009, ZINC000003861746

Download	Molfile XML SDF

Formula

C8H13N2O6

Net Charge

-1

Average Mass

233.199

Monoisotopic Mass

233.07791

InChI

InChI=1S/C8H14N2O6/c9-1-2-10-5(11)3-8(16,7(14)15)4-6(12)13/h16H,1-4,9H2,(H,10,11)(H,12,13)(H,14,15)/p-1/t8-/m0/s1

InChIKey

KQWWDTIPDRWKGZ-QMMMGPOBSA-M

SMILES

O=C(NCC[NH3+])C[C@](CC(=O)[O-])(C([O-])=O)O

ChEBI Ontology
Outgoing	2-[(2-aminoethylcarbamoyl)methyl]-2-hydroxybutanedioate (CHEBI:142970) is a organic molecular entity (CHEBI:50860)

Synonym	Source
2-[(2-aminoethylcarbamoyl)methyl]-2-hydroxybutanedioate	UniProt

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