(1R,5aS,6R)-4a-Hydroxy-1,4,4a,5,5a,6,9,10a-octahydrophenazine-1,6-dicarboxylate

Properties Image MNX_ID MNXM163023 reference chebi:176942 formula C14H16N2O5 global charge 0 mol weight 292.291 InChIKey IZJBZSNXJLOCHK-VMHMYJSPSA-N InChI InChI=1S/C14H16N2O5/c17-12(18)7-3-1-5-9-10(7)16-14(21)6-2-4-8(13(19)20)11(14)15-9/h1-4,7-8,10-11,16,21H,5-6H2,(H,17,18)(H,19,20)/t7-,8-,10+,11?,14?/m1/s1 SMILES O=C(O)[C@@H]1C=CCC2(O)N[C@@H]3C(=NC12)CC=C[C@H]3C(=O)O MNX internals InChI (mnx) InChI=1/C14H16N2O5/c17-12(18)7-3-1-5-9-10(7)16-14(21)6-2-4-8(13(19)20)11(14)15-9/h1-4,7-8,10-11,16,21H,5-6H2,(H,17,18)(H,19,20)/t7-,8-,10+,11?,14?/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][C@@H:7]([C:12](=[O:17])[OH:18])[C@H:10]2[C:9](=[N:15][CH:11]3[C@H:8]([C:13](=[O:19])[OH:20])[CH:4]=[CH:2][CH2:6][C:14]3([OH:21])[NH:16]2)[CH2:5]1

Parent-child relations graph

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