3a-(2-amino-2-carboxyethyl)-4,5-dioxo-4,5,6,7,8,9-hexahydroquinoline-7,9-dicarboxylate

Properties Image MNX_ID MNXM1372077 reference seedM:cpd23266 formula C14H14N2O8 global charge -2 mol weight 338.272 InChIKey SUWXHEWDCTXYOI-UHFFFAOYSA-L InChI InChI=1S/C14H16N2O8/c15-7(13(21)22)2-4-1-5-6(12(19)20)3-8(14(23)24)16-9(5)11(18)10(4)17/h1,5-8,16,18H,2-3,15H2,(H,19,20)(H,21,22)(H,23,24)/p-2 SMILES [NH3+]C(CC1=CC2C(=C(O)C1=O)NC(C(=O)[O-])CC2C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C14H16N2O8/c15-7(13(21)22)2-4-1-5-6(12(19)20)3-8(14(23)24)16-9(5)11(18)10(4)17/h1,5-8,16,18H,2-3,15H2,(H,19,20)(H,21,22)(H,23,24)/t5?,6?,7?,8? SMILES (mnx) [CH:1]1=[C:4]([CH2:2][CH:7]([C:13](=[O:21])[OH:22])[NH2:15])[C:10](=[O:17])[C:11]([OH:18])=[C:9]2[CH:5]1[CH:6]([C:12](=[O:19])[OH:20])[CH2:3][CH:8]([C:14](=[O:23])[OH:24])[NH:16]2

Parent-child relations graph

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