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Asp-Ala-Asn

PropertiesImage
MNX_IDMNXM1122884 Image of MNXM1122884
referencechebi:160281
formulaC11H18N4O7
global charge0
mol weight318.286
InChIKeyKDFQZBWWPYQBEN-ZLUOBGJFSA-N
InChIInChI=1S/C11H18N4O7/c1-4(14-10(20)5(12)2-8(17)18)9(19)15-6(11(21)22)3-7(13)16/h4-6H,2-3,12H2,1H3,(H2,13,16)(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1
SMILESC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C11H18N4O7/c1-4(14-10(20)5(12)2-8(17)18)9(19)15-6(11(21)22)3-7(13)16/h4-6H,2-3,12H2,1H3,(H2,13,16)(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1 Image of MNXM1122884
SMILES (mnx)[CH3:1][C@@H:4]([C:9](=[N:15][C@@H:6]([CH2:3][C:7](=[NH:13])[OH:16])[C:11](=[O:21])[OH:22])[OH:19])[N:14]=[C:10]([C@H:5]([CH2:2][C:8](=[O:17])[OH:18])[NH2:12])[OH:20]
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:160281
chebi:160281
KDFQZBWWPYQBEN-ZLUOBGJFSA-N
Asp-Ala-Asn
(3S)-3-amino-4-[[(2S)-1-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid