bis(myo-inositol) 1,3'-phosphate

Properties Image MNX_ID MNXM18842 reference chebi:142886 formula C12H22O14P global charge -1 mol weight 421.268 InChIKey FIIUDBCIQWHEHT-VOEMVRBLSA-M InChI InChI=1S/C12H23O14P/c13-1-3(15)7(19)11(8(20)4(1)16)25-27(23,24)26-12-9(21)5(17)2(14)6(18)10(12)22/h1-22H,(H,23,24)/p-1/t1-,2-,3-,4+,5-,6+,7-,8-,9+,10+,11-,12- SMILES O=P([O-])(O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C12H23O14P/c13-1-3(15)7(19)11(8(20)4(1)16)25-27(23,24)26-12-9(21)5(17)2(14)6(18)10(12)22/h1-22H,(H,23,24)/t1-,2-,3-,4+,5-,6+,7-,8-,9+,10+,11-,12- SMILES (mnx) [C@H:1]1([OH:13])[C@H:3]([OH:15])[C@H:7]([OH:19])[C@H:11]([O:25][P:27]([OH:23])(=[O:24])[O:26][C@H:12]2[C@H:9]([OH:21])[C@@H:5]([OH:17])[C@H:2]([OH:14])[C@@H:6]([OH:18])[C@H:10]2[OH:22])[C@@H:8]([OH:20])[C@@H:4]1[OH:16]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 2