Asp-Pro-Asn

Properties Image MNX_ID MNXM1123430 reference chebi:160831 formula C13H20N4O7 global charge 0 mol weight 344.324 InChIKey BWJZSLQJNBSUPM-FXQIFTODSA-N InChI InChI=1S/C13H20N4O7/c14-6(4-10(19)20)12(22)17-3-1-2-8(17)11(21)16-7(13(23)24)5-9(15)18/h6-8H,1-5,14H2,(H2,15,18)(H,16,21)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1 SMILES NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)C(=O)O MNX internals InChI (mnx) InChI=1/C13H20N4O7/c14-6(4-10(19)20)12(22)17-3-1-2-8(17)11(21)16-7(13(23)24)5-9(15)18/h6-8H,1-5,14H2,(H2,15,18)(H,16,21)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1 SMILES (mnx) [CH2:1]1[CH2:2][C@@H:8]([C:11](=[N:16][C@@H:7]([CH2:5][C:9](=[NH:15])[OH:18])[C:13](=[O:23])[OH:24])[OH:21])[N:17]([C:12]([C@H:6]([CH2:4][C:10](=[O:19])[OH:20])[NH2:14])=[O:22])[CH2:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0