1-(15-methylhexadecanoyl)-2-dodecanoyl-3-tridecanoyl-sn-glycerol

Properties Image MNX_ID MNXM230144 reference slm:000126348 formula C45H86O6 global charge 0 mol weight 723.177 InChIKey RILSBEUDJGIFMU-WBCKFURZSA-N InChI InChI=1S/C45H86O6/c1-5-7-9-11-13-15-21-24-28-32-36-43(46)49-39-42(51-45(48)38-34-30-26-19-14-12-10-8-6-2)40-50-44(47)37-33-29-25-22-18-16-17-20-23-27-31-35-41(3)4/h41-42H,5-40H2,1-4H3/t42-/m0/s1 SMILES CCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C45H86O6/c1-5-7-9-11-13-15-21-24-28-32-36-43(46)49-39-42(51-45(48)38-34-30-26-19-14-12-10-8-6-2)40-50-44(47)37-33-29-25-22-18-16-17-20-23-27-31-35-41(3)4/h41-42H,5-40H2,1-4H3/t42-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:21][CH2:24][CH2:28][CH2:32][CH2:36][C:43](=[O:46])[O:49][CH2:39][C@@H:42]([CH2:40][O:50][C:44]([CH2:37][CH2:33][CH2:29][CH2:25][CH2:22][CH2:18][CH2:16][CH2:17][CH2:20][CH2:23][CH2:27][CH2:31][CH2:35][CH:41]([CH3:3])[CH3:4])=[O:47])[O:51][C:45]([CH2:38][CH2:34][CH2:30][CH2:26][CH2:19][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:48]

Parent-child relations graph

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