3-phosphoshikimate

Properties Image MNX_ID MNXM1265 reference chebi:145989 formula C7H8O8P global charge -3 mol weight 251.107 InChIKey QYOJSKGCWNAKGW-PBXRRBTRSA-K InChI InChI=1S/C7H11O8P/c8-4-1-3(7(10)11)2-5(6(4)9)15-16(12,13)14/h2,4-6,8-9H,1H2,(H,10,11)(H2,12,13,14)/p-3/t4-,5-,6+/m1/s1 SMILES O=C([O-])C1=C[C@@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](O)C1 MNX internals InChI (mnx) InChI=1/C7H11O8P/c8-4-1-3(7(10)11)2-5(6(4)9)15-16(12,13)14/h2,4-6,8-9H,1H2,(H,10,11)(H2,12,13,14)/t4-,5-,6+/m1/s1 SMILES (mnx) [CH2:1]1[C:3]([C:7](=[O:10])[OH:11])=[CH:2][C@@H:5]([O:15][P:16]([OH:12])([OH:13])=[O:14])[C@@H:6]([OH:9])[C@@H:4]1[OH:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 4