1-butanoyl-2-dodecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)

Properties Image MNX_ID MNXM344276 reference slm:000475769 formula C22H41O13P2 global charge -3 mol weight 575.505 InChIKey ZAAJCHXYSQBSGV-VQTJNVASSA-K InChI InChI=1S/C22H44O13P2/c1-3-5-6-7-8-9-10-11-12-14-22(25)35-20(17-31-21(24)13-4-2)18-34-37(29,30)33-16-19(23)15-32-36(26,27)28/h19-20,23H,3-18H2,1-2H3,(H,29,30)(H2,26,27,28)/p-3/t19-,20+/m0/s1 SMILES CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C22H44O13P2/c1-3-5-6-7-8-9-10-11-12-14-22(25)35-20(17-31-21(24)13-4-2)18-34-37(29,30)33-16-19(23)15-32-36(26,27)28/h19-20,23H,3-18H2,1-2H3,(H,29,30)(H2,26,27,28)/t19-,20+/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:14][C:22](=[O:25])[O:35][C@H:20]([CH2:17][O:31][C:21]([CH2:13][CH2:4][CH3:2])=[O:24])[CH2:18][O:34][P:37]([OH:29])(=[O:30])[O:33][CH2:16][C@H:19]([CH2:15][O:32][P:36]([OH:26])([OH:27])=[O:28])[OH:23]

Parent-child relations graph

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