N-acetyl-seryl-aspartate

Properties Image MNX_ID MNXM725868 reference biggM:CE5868 formula C9H12N2O7 global charge -2 mol weight 260.202 InChIKey GFPWFSOXDSNMDC-RITPCOANSA-L InChI InChI=1S/C9H14N2O7/c1-4(13)10-6(3-12)8(16)11-5(9(17)18)2-7(14)15/h5-6,12H,2-3H2,1H3,(H,10,13)(H,11,16)(H,14,15)(H,17,18)/p-2/t5-,6+/m1/s1 SMILES CC([O-])=N[C@@H](CO)C(O)=N[C@H](CC(=O)[O-])C(=O)O MNX internals InChI (mnx) InChI=1/C9H14N2O7/c1-4(13)10-6(3-12)8(16)11-5(9(17)18)2-7(14)15/h5-6,12H,2-3H2,1H3,(H,10,13)(H,11,16)(H,14,15)(H,17,18)/t5-,6+/m1/s1 SMILES (mnx) [CH3:1][C:4](=[N:10][C@@H:6]([CH2:3][OH:12])[C:8](=[N:11][C@H:5]([CH2:2][C:7](=[O:14])[OH:15])[C:9](=[O:17])[OH:18])[OH:16])[OH:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 3