1,2-dioctanoyl-sn-glycero-3-diphosphate

Properties Image MNX_ID MNXM146753 reference chebi:82765 formula C19H35O11P2 global charge -3 mol weight 501.426 InChIKey MBDSUZSCJLRKPC-QGZVFWFLSA-K InChI InChI=1S/C19H38O11P2/c1-3-5-7-9-11-13-18(20)27-15-17(16-28-32(25,26)30-31(22,23)24)29-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,25,26)(H2,22,23,24)/p-3/t17-/m1/s1 SMILES CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OP(=O)([O-])[O-])OC(=O)CCCCCCC MNX internals InChI (mnx) InChI=1/C19H38O11P2/c1-3-5-7-9-11-13-18(20)27-15-17(16-28-32(25,26)30-31(22,23)24)29-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,25,26)(H2,22,23,24)/t17-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][C:18](=[O:20])[O:27][CH2:15][C@H:17]([CH2:16][O:28][P:32]([OH:25])(=[O:26])[O:30][P:31]([OH:22])([OH:23])=[O:24])[O:29][C:19]([CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1