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carnosine

PropertiesImage
MNX_IDMNXM726951 Image of MNXM726951
referencechebi:57485
formulaC9H14N4O3
global charge0
mol weight226.236
InChIKeyCQOVPNPJLQNMDC-ZETCQYMHSA-N
InChIInChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1
SMILES[NH3+]CCC(=O)N[C@@H](CC1=CNC=N1)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1 Image of MNXM726951
SMILES (mnx)[CH2:1]([CH2:2][NH2:10])[C:8](=[N:13][C@@H:7]([CH2:3][C:6]1=[CH:4][N:11]=[CH:5][NH:12]1)[C:9](=[O:15])[OH:16])[OH:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 18
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-6786250
reactomeM:R-ALL-6786250
CHEBI:57485
chebi:57485
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		carnosine
(2S)-2-[(3-azaniumylpropanoyl)amino]-3-(1H-imidazol-4-yl)propanoate
N(alpha)-(beta-alaniniumyl)-L-histidinate
carnosine zwitterion
hmdb:HMDB0000033
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		Carnosine
(2S)-2-(3-aminopropanamido)-3-(1H-imidazol-5-yl)propanoic acid
Carnosine hydrochloride
Carnosine, (D-his)-isomer
Hydrochloride, carnosine
Ignotine
Karnozin
Karnozzn
L Carnosine
L-Carnosine
N-(3-Aminopropanoyl)histidine
N-(b-Alanyl)-L-histidine
N-b-Alanyl-L-histidine
N-beta-Alanyl-L-histidine
Nalpha-(b-alanyl)-L-histidine
Nalpha-(beta-alanyl)-L-histidine
Sevitin
b-Alanyl-L-histidine
b-Alanylhistidine
beta Alanylhistidine
beta-Alanyl-L-histidine
beta-Alanylhistidine
beta-alanyl-L-histidine

seed.compound:cpd00310
seedM:cpd00310
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		Carnosine
N-beta-alanyl-L-histidine
Nalpha-(beta-alanyl)-L-histidine
carnosine
ignotine

sabiork.compound:5064
sabiorkM:5064
kegg.compound:C00386
keggC:C00386
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		Carnosine
Nalpha-(beta-alanyl)-L-histidine

bigg.metabolite:carn
biggM:carn
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		L-Carnosine

seed.compound:cpd15836
seedM:cpd15836
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		L-Carnosine
carn

vmhM:alahis
vmhmetabolite:alahis
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		L-alanyl-L-histidine
(2S)-2-(3-aminopropanamido)-3-(1H-imidazol-5-yl)propanoic acid

CHEBI:66874
chebi:66874
CQOVPNPJLQNMDC-ZETCQYMHSA-M 		carnosinate
(2S)-2-(beta-alanylamino)-3-(1H-imidazol-4-yl)propanoate
N(alpha)-(beta-alanyl)-L-histidinate
carnosinate anion
carnosinate(1-)

CHEBI:15727
chebi:15727
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		carnosine
(2S)-2-(3-aminopropanamido)-3-(1H-imidazol-4-yl)propanoic acid
Carnosine
Karnozin
Karnozzn
L-carnosine
N(alpha)-(beta-alanyl)-L-histidine
N-(3-aminopropanoyl)-L-histidine
N-2-M
N-beta-alanyl-L-histidine
Nalpha-(beta-alanyl)-L-histidine
beta-alanyl-L-histidine
ignotine

vmhM:carn
vmhmetabolite:carn
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		carnosine
(2S)-2-(3-aminopropanamido)-3-(1H-imidazol-5-yl)propanoic acid

metacyc.compound:CARNOSINE
metacycM:CARNOSINE
CQOVPNPJLQNMDC-ZETCQYMHSA-N 		carnosine
N-beta-alanyl-L-histidine
ignotine

hmdb:HMDB00033
chebi:13948
chebi:23040
chebi:3428
biggM:M_carn
keggC:M_C00386
seedM:M_cpd00310
seedM:M_cpd15836
vmhM:M_alahis
vmhM:M_carn 		secondary/obsolete/fantasy identifier