1D-myo-inositol 1,2,3,5,6-pentakisphosphate

Properties Image MNX_ID MNXM733902 reference chebi:58747 formula C6H7O21P5 global charge -10 mol weight 569.971 InChIKey CTPQAXVNYGZUAJ-UOTPTPDRSA-D InChI InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/p-10/t1-,2-,3+,4-,5-,6-/m1/s1 SMILES O=P([O-])([O-])O[C@@H]1[C@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](OP(=O)([O-])[O-])[C@H]1OP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2-,3+,4-,5-,6-/m1/s1 SMILES (mnx) [C@@H:1]1([OH:7])[C@@H:2]([O:23][P:28]([OH:8])([OH:9])=[O:10])[C@@H:4]([O:25][P:30]([OH:14])([OH:15])=[O:16])[C@@H:6]([O:27][P:32]([OH:20])([OH:21])=[O:22])[C@H:5]([O:26][P:31]([OH:17])([OH:18])=[O:19])[C@H:3]1[O:24][P:29]([OH:11])([OH:12])=[O:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 2