1-(15-methylhexadecanoyl)-2-heptadecanoyl-3-eicosanoyl-sn-glycerol

Properties Image MNX_ID MNXM230326 reference slm:000178423 formula C57H110O6 global charge 0 mol weight 891.501 InChIKey FDYCVBCDFWHYIQ-XSMLMOGHSA-N InChI InChI=1S/C57H110O6/c1-5-7-9-11-13-15-17-19-21-22-23-25-28-32-36-40-44-48-55(58)61-51-54(63-57(60)50-46-42-38-34-29-24-20-18-16-14-12-10-8-6-2)52-62-56(59)49-45-41-37-33-30-26-27-31-35-39-43-47-53(3)4/h53-54H,5-52H2,1-4H3/t54-/m0/s1 SMILES CCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C57H110O6/c1-5-7-9-11-13-15-17-19-21-22-23-25-28-32-36-40-44-48-55(58)61-51-54(63-57(60)50-46-42-38-34-29-24-20-18-16-14-12-10-8-6-2)52-62-56(59)49-45-41-37-33-30-26-27-31-35-39-43-47-53(3)4/h53-54H,5-52H2,1-4H3/t54-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:25][CH2:28][CH2:32][CH2:36][CH2:40][CH2:44][CH2:48][C:55](=[O:58])[O:61][CH2:51][C@@H:54]([CH2:52][O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:30][CH2:26][CH2:27][CH2:31][CH2:35][CH2:39][CH2:43][CH2:47][CH:53]([CH3:3])[CH3:4])=[O:59])[O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:29][CH2:24][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:60]

Parent-child relations graph

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