(2S,3S)-3-methyl-L-aspartate

Properties Image MNX_ID MNXM1444 reference chebi:58724 formula C5H8NO4 global charge -1 mol weight 146.122 InChIKey LXRUAYBIUSUULX-HRFVKAFMSA-M InChI InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/p-1/t2-,3-/m0/s1 SMILES C[C@H](C(=O)[O-])[C@H]([NH3+])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1 SMILES (mnx) [CH3:1][C@@H:2]([C@@H:3]([C:5](=[O:9])[OH:10])[NH2:6])[C:4](=[O:7])[OH:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 1