1-(4-sulfophenyl)-3-carboxy-4-amino-5-oxopyrazole

Properties Image MNX_ID MNXM32468 reference chebi:59995 formula C10H9N3O6S global charge 0 mol weight 299.264 InChIKey VBKMDGXBOWYWHE-UHFFFAOYSA-N InChI InChI=1S/C10H9N3O6S/c11-7-8(10(15)16)12-13(9(7)14)5-1-3-6(4-2-5)20(17,18)19/h1-4,7H,11H2,(H,15,16)(H,17,18,19) SMILES NC1C(=O)N(C2=CC=C(S(=O)(=O)O)C=C2)N=C1C(=O)O MNX internals InChI (mnx) InChI=1/C10H9N3O6S/c11-7-8(10(15)16)12-13(9(7)14)5-1-3-6(4-2-5)20(17,18)19/h1-4,7H,11H2,(H,15,16)(H,17,18,19)/t7? SMILES (mnx) [CH:1]1=[CH:3][C:6]([S:20]([OH:17])(=[O:18])=[O:19])=[CH:4][CH:2]=[C:5]1[N:13]1[C:9](=[O:14])[CH:7]([NH2:11])[C:8]([C:10]([OH:15])=[O:16])=[N:12]1

Parent-child relations graph

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