1-acetyl-2-propionyl-sn-glycero-3-phospho-1D-myo-inositol-5-phosphate

Properties Image MNX_ID MNXM343206 reference slm:000437312 formula C14H23O16P2 global charge -3 mol weight 509.27 InChIKey IAAXVQJTALQMKC-COXDTDAOSA-K InChI InChI=1S/C14H26O16P2/c1-3-8(16)28-7(4-26-6(2)15)5-27-32(24,25)30-14-11(19)9(17)10(18)13(12(14)20)29-31(21,22)23/h7,9-14,17-20H,3-5H2,1-2H3,(H,24,25)(H2,21,22,23)/p-3/t7-,9-,10-,11-,12-,13+,14-/m1/s1 SMILES CCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](O)[C@@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C14H26O16P2/c1-3-8(16)28-7(4-26-6(2)15)5-27-32(24,25)30-14-11(19)9(17)10(18)13(12(14)20)29-31(21,22)23/h7,9-14,17-20H,3-5H2,1-2H3,(H,24,25)(H2,21,22,23)/t7-,9-,10-,11-,12-,13+,14-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][C:8](=[O:16])[O:28][C@H:7]([CH2:4][O:26][C:6]([CH3:2])=[O:15])[CH2:5][O:27][P:32]([OH:24])(=[O:25])[O:30][C@@H:14]1[C@H:11]([OH:19])[C@H:9]([OH:17])[C@@H:10]([OH:18])[C@H:13]([O:29][P:31]([OH:21])([OH:22])=[O:23])[C@H:12]1[OH:20]

Parent-child relations graph

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