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Asn-Asp-Ser

PropertiesImage
MNX_IDMNXM1122233 Image of MNXM1122233
referencechebi:159624
formulaC11H18N4O8
global charge0
mol weight334.285
InChIKeyVYLVOMUVLMGCRF-ZLUOBGJFSA-N
InChIInChI=1S/C11H18N4O8/c12-4(1-7(13)17)9(20)14-5(2-8(18)19)10(21)15-6(3-16)11(22)23/h4-6,16H,1-3,12H2,(H2,13,17)(H,14,20)(H,15,21)(H,18,19)(H,22,23)/t4-,5-,6-/m0/s1
SMILESNC(=O)C[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O
MNX internals
InChI (mnx)InChI=1/C11H18N4O8/c12-4(1-7(13)17)9(20)14-5(2-8(18)19)10(21)15-6(3-16)11(22)23/h4-6,16H,1-3,12H2,(H2,13,17)(H,14,20)(H,15,21)(H,18,19)(H,22,23)/t4-,5-,6-/m0/s1 Image of MNXM1122233
SMILES (mnx)[CH2:1]([C@@H:4]([C:9](=[N:14][C@@H:5]([CH2:2][C:8](=[O:18])[OH:19])[C:10](=[N:15][C@@H:6]([CH2:3][OH:16])[C:11](=[O:22])[OH:23])[OH:21])[OH:20])[NH2:12])[C:7](=[NH:13])[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:159624
chebi:159624
VYLVOMUVLMGCRF-ZLUOBGJFSA-N
Asn-Asp-Ser
(3S)-4-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-3-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-4-oxobutanoic acid