(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate

Properties Image MNX_ID MNXM162445 reference chebi:131973 formula C14H10N2O4 global charge -2 mol weight 270.244 InChIKey CUYPWOPOBAHCCE-PELKAZGASA-L InChI InChI=1S/C14H12N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-5,8,12,15H,6H2,(H,17,18)(H,19,20)/p-2/t8-,12+/m1/s1 SMILES O=C([O-])C1=CC=CC2=C1N=C1CC=C[C@@H](C(=O)[O-])[C@@H]1N2 MNX internals InChI (mnx) InChI=1/C14H12N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-5,8,12,15H,6H2,(H,17,18)(H,19,20)/t8-,12+/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][C:7]([C:13](=[O:17])[OH:18])=[C:11]2[C:9](=[CH:5]1)[NH:15][C@H:12]1[C@H:8]([C:14](=[O:19])[OH:20])[CH:4]=[CH:2][CH2:6][C:10]1=[N:16]2

Parent-child relations graph

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