2,3-bis-O-(phytanyl)-sn-glycerol 1-phosphate

Properties Image MNX_ID MNXM145628 reference chebi:73125 formula C43H87O6P global charge -2 mol weight 731.137 InChIKey UKQGAMWGTOTQPC-ALOLAALWSA-L InChI InChI=1S/C43H89O6P/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-47-33-43(34-49-50(44,45)46)48-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h35-43H,11-34H2,1-10H3,(H2,44,45,46)/p-2/t37-,38-,39-,40-,41-,42-,43+/m1/s1 SMILES CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@H](C)CCOC[C@@H](COP(=O)([O-])[O-])OCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C MNX internals InChI (mnx) InChI=1/C43H89O6P/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-47-33-43(34-49-50(44,45)46)48-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h35-43H,11-34H2,1-10H3,(H2,44,45,46)/t37-,38-,39-,40-,41-,42-,43+/m1/s1 SMILES (mnx) [CH3:1][CH:35]([CH3:2])[CH2:17][CH2:11][CH2:19][C@@H:37]([CH3:5])[CH2:21][CH2:13][CH2:23][C@@H:39]([CH3:7])[CH2:25][CH2:15][CH2:27][C@@H:41]([CH3:9])[CH2:29][CH2:31][O:47][CH2:33][C@@H:43]([CH2:34][O:49][P:50]([OH:44])([OH:45])=[O:46])[O:48][CH2:32][CH2:30][C@H:42]([CH3:10])[CH2:28][CH2:16][CH2:26][C@H:40]([CH3:8])[CH2:24][CH2:14][CH2:22][C@H:38]([CH3:6])[CH2:20][CH2:12][CH2:18][CH:36]([CH3:3])[CH3:4]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 10 in models (compartimentalized) 4