N(alpha)-citryl-N(epsilon)-acetyl-N(epsilon)-hydroxylysine(3-) (CHEBI:63796)

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CHEBI:63796 - N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine(3−)

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ChEBI ID	CHEBI:63796
ChEBI Name	N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine(3−)
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ASCII Name	N(alpha)-citryl-N(epsilon)-acetyl-N(epsilon)-hydroxylysine(3-)
Definition	A tricarboxylic acid trianion obtained by deprotonation of the three carboxy groups of N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine.
Last Modified	1 May 2019
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C14H19N2O10
Net Charge	-3
Average Mass	375.310
Monoisotopic Mass	375.10562
SMILES	CC(=O)N(O)CCCC[C@H](NC(=O)CC(O)(CC(=O)[O-])C(=O)[O-])C(=O)[O-]
InChI	InChI=1S/C14H22N2O10/c1-8(17)16(26)5-3-2-4-9(12(21)22)15-10(18)6-14(25,13(23)24)7-11(19)20/h9,25-26H,2-7H2,1H3,(H,15,18)(H,19,20)(H,21,22)(H,23,24)/p-3/t9-,14?/m0/s1
InChIKey	HPOPJZNNZCIWFX-CUVJYRNJSA-K

ChEBI Ontology

Outgoing Relation(s)
	N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine(3−) (CHEBI:63796) is a tricarboxylic acid trianion (CHEBI:27092)
	N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine(3−) (CHEBI:63796) is conjugate base of N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine (CHEBI:63801)
Incoming Relation(s)
	N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine (CHEBI:63801) is conjugate acid of N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine(3−) (CHEBI:63796)

IUPAC Name
2-[2-({(1S)-5-[acetyl(hydroxy)amino]-1-carboxylatopentyl}amino)-2-oxoethyl]-2-hydroxysuccinate

Synonym	Source
N^α-citryl-N^ε-acetyl-N^ε-hydroxylysine trianion	ChEBI

UniProt Name	Source
N²-citryl-N⁶-acetyl-N⁶-hydroxy-L-lysine	UniProt

Citations