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ophthalmic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM65600

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₁H₁₉N₃O₆

charge

mass

289.12739

reference

InChIKey

JCMUOFQHZLPHQP-BQBZGAKWSA-N

InChI

InChI=1S/C11H19N3O6/c1-2-7(10(18)13-5-9(16)17)14-8(15)4-3-6(12)11(19)20/h6-7H,2-5,12H2,1H3,(H,13,18)(H,14,15)(H,16,17)(H,19,20)/t6-,7-/m0/s1

SMILES

CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:84058 chebi:84058	ophthalmic acid N-{(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}-L-glutamine
seed.compound:cpd35796 seedM:cpd35796	N-{(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}-L-glutamine ophthalmate ophthalmic acid
kegg.compound:C21016 keggC:C21016	Ophthalmate gamma-L-Glutamyl-L-2-aminobutyrylglycine
sabiork.compound:25393 sabiorkM:25393	Ophthalmic acid
hmdb:HMDB0005765	Ophthalmic acid (2S)-2-amino-4-{[(1S)-1-[(carboxymethyl)carbamoyl]propyl]carbamoyl}butanoic acid L-gamma-Glutamyl-(2S)-2-aminobutanoylglycine L-gamma-Glutamyl-L-alpha-aminobutyrylglycine Ophthalmate gamma-Glu-alpha-aminobutyryl-gly gamma-Glutamyl-alpha-amino-n-butyrylglycine ophthalmic acid
metacyc.compound:CPD-20340 metacycM:CPD-20340	ophthalmate (gamma-L-glutamyl-(S)-2-aminobutanoyl-glycine N-{(2S)-1-[(carboxymethyl)amino]-1-oxobutan-2-yl}-L-glutamine ophthalmic acid
hmdb:HMDB05765 keggC:M_C21016 seedM:M_cpd35796	secondary/obsolete/fantasy identifier