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Arg-Ala-Ala

PropertiesImage
MNX_IDMNXM744617 Image of MNXM744617
referencechebi:158681
formulaC12H24N6O4
global charge0
mol weight316.362
InChIKeyOOBVTWHLKYJFJH-FXQIFTODSA-N
InChIInChI=1S/C12H24N6O4/c1-6(9(19)18-7(2)11(21)22)17-10(20)8(13)4-3-5-16-12(14)15/h6-8H,3-5,13H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)(H4,14,15,16)/t6-,7-,8-/m0/s1
SMILESC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O
MNX internals
InChI (mnx)InChI=1/C12H24N6O4/c1-6(9(19)18-7(2)11(21)22)17-10(20)8(13)4-3-5-16-12(14)15/h6-8H,3-5,13H2,1-2H3,(H,17,20)(H,18,19)(H,21,22)(H4,14,15,16)/t6-,7-,8-/m0/s1 Image of MNXM744617
SMILES (mnx)[CH3:1][C@@H:6]([C:9](=[N:18][C@@H:7]([CH3:2])[C:11](=[O:21])[OH:22])[OH:19])[N:17]=[C:10]([C@H:8]([CH2:4][CH2:3][CH2:5][NH:16][C:12](=[NH:14])[NH2:15])[NH2:13])[OH:20]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:158681
chebi:158681
OOBVTWHLKYJFJH-FXQIFTODSA-N
Arg-Ala-Ala
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propanoyl]amino]propanoic acid

bigg.metabolite:argalaala
biggM:argalaala
vmhM:argalaala
vmhmetabolite:argalaala
OOBVTWHLKYJFJH-FXQIFTODSA-N
OOBVTWHLKYJFJH-FXQIFTODSA-O
Arginyl-Alanyl-Alanine

biggM:M_argalaala
vmhM:M_argalaala
secondary/obsolete/fantasy identifier