Search MNXref
 Feedback

N-acetyl-L-aspartyl-L-glutamyl-L-glutamate

PropertiesImage
MNX_IDMNXM146183 Image of MNXM146183
referencechebi:76935
formulaC16H19N3O11
global charge-4
mol weight429.338
InChIKeyXNHNFLZMOUNVIW-GUBZILKMSA-J
InChIInChI=1S/C16H23N3O11/c1-7(20)17-10(6-13(25)26)15(28)18-8(2-4-11(21)22)14(27)19-9(16(29)30)3-5-12(23)24/h8-10H,2-6H2,1H3,(H,17,20)(H,18,28)(H,19,27)(H,21,22)(H,23,24)(H,25,26)(H,29,30)/p-4/t8-,9-,10-/m0/s1
SMILESCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](CCC(=O)[O-])C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C16H23N3O11/c1-7(20)17-10(6-13(25)26)15(28)18-8(2-4-11(21)22)14(27)19-9(16(29)30)3-5-12(23)24/h8-10H,2-6H2,1H3,(H,17,20)(H,18,28)(H,19,27)(H,21,22)(H,23,24)(H,25,26)(H,29,30)/t8-,9-,10-/m0/s1 Image of MNXM146183
SMILES (mnx)[CH3:1][C:7](=[N:17][C@@H:10]([CH2:6][C:13](=[O:25])[OH:26])[C:15](=[N:18][C@@H:8]([CH2:2][CH2:4][C:11](=[O:21])[OH:22])[C:14](=[N:19][C@@H:9]([CH2:3][CH2:5][C:12](=[O:23])[OH:24])[C:16](=[O:29])[OH:30])[OH:27])[OH:28])[OH:20]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:76935
chebi:76935
XNHNFLZMOUNVIW-GUBZILKMSA-J 		N-acetyl-L-aspartyl-L-glutamyl-L-glutamate
(2S)-2-({N-[(2S)-2-acetamido-3-carboxylatopropanoyl]-5-oxidanidyl-5-oxidanylidene-L-norvalyl}amino)pentanedioate
Ac-Asp-Glu-Glu(4-)
N-acetyl-L-alpha-aspartyl-L-glutamyl-L-glutamate

CHEBI:77064
chebi:77064
XNHNFLZMOUNVIW-GUBZILKMSA-N 		Ac-Asp-Glu-Glu
Ac-DEE
Ac-L-Asp-L-Glu-L-Glu
N-acetyl-L-alpha-aspartyl-L-alpha-glutamyl-L-glutamic acid
N-acetyl-alpha-aspartyl-alpha-glutamylglutamic acid
N-acetylaspartylglutamylglutamic acid

seed.compound:cpd31341
seedM:cpd31341
XNHNFLZMOUNVIW-GUBZILKMSA-J 		N-Acetylaspartylglutamylglutamate
N-Acetyl-L-aspartyl-L-glutamyl-L-glutamate
N-acetyl-L-aspartyl-L-glutamyl-L-glutamate
N-acetyl-alpha-L-aspartyl-L-glutamyl-L-glutamate
NAAG2

kegg.compound:C20776
keggC:C20776
XNHNFLZMOUNVIW-GUBZILKMSA-N 		N-Acetylaspartylglutamylglutamate
N-Acetyl-L-aspartyl-L-glutamyl-L-glutamate
NAAG2

metacyc.compound:CPD-16471
metacycM:CPD-16471
XNHNFLZMOUNVIW-GUBZILKMSA-J 		N-acetyl-alpha-L-aspartyl-L-glutamyl-L-glutamate
N-acetyl-L-aspartyl-L-glutamyl-L-glutamate

keggC:M_C20776
seedM:M_cpd31341 		secondary/obsolete/fantasy identifier