2-(11Z-octadecenoyl)-sn-glycero-1-phospho-(2'-(11E-octadecenoyl)-1'-sn-glycerol)

Properties Image MNX_ID MNXM469695 reference slm:000485141 formula C42H78O10P global charge -1 mol weight 774.05 InChIKey KQWTVSQUFLFYIX-SAMJYNIKSA-M InChI InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)51-39(35-43)37-49-53(47,48)50-38-40(36-44)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,39-40,43-44H,3-12,17-38H2,1-2H3,(H,47,48)/p-1/b15-13-,16-14+/t39-,40-/m0/s1 SMILES CCCCCC/C=C\CCCCCCCCCC(=O)O[C@@H](CO)COP(=O)([O-])OC[C@H](CO)OC(=O)CCCCCCCCC/C=C/CCCCCC MNX internals InChI (mnx) InChI=1/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)51-39(35-43)37-49-53(47,48)50-38-40(36-44)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,39-40,43-44H,3-12,17-38H2,1-2H3,(H,47,48)/b15-13-,16-14+/t39-,40-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][C:41](=[O:45])[O:51][C@@H:39]([CH2:35][OH:43])[CH2:37][O:49][P:53]([OH:47])(=[O:48])[O:50][CH2:38][C@H:40]([CH2:36][OH:44])[O:52][C:42]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:46]

Parent-child relations graph

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