Search MNXref
 Feedback

Asp-Ala-Ala

PropertiesImage
MNX_IDMNXM1122880 Image of MNXM1122880
referencechebi:160277
formulaC10H17N3O6
global charge0
mol weight275.261
InChIKeyKRXIWXCXOARFNT-ZLUOBGJFSA-N
InChIInChI=1S/C10H17N3O6/c1-4(8(16)13-5(2)10(18)19)12-9(17)6(11)3-7(14)15/h4-6H,3,11H2,1-2H3,(H,12,17)(H,13,16)(H,14,15)(H,18,19)/t4-,5-,6-/m0/s1
SMILESC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C10H17N3O6/c1-4(8(16)13-5(2)10(18)19)12-9(17)6(11)3-7(14)15/h4-6H,3,11H2,1-2H3,(H,12,17)(H,13,16)(H,14,15)(H,18,19)/t4-,5-,6-/m0/s1 Image of MNXM1122880
SMILES (mnx)[CH3:1][C@@H:4]([C:8](=[N:13][C@@H:5]([CH3:2])[C:10](=[O:18])[OH:19])[OH:16])[N:12]=[C:9]([C@H:6]([CH2:3][C:7](=[O:14])[OH:15])[NH2:11])[OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:160277
chebi:160277
KRXIWXCXOARFNT-ZLUOBGJFSA-N
Asp-Ala-Ala
(3S)-3-amino-4-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid