1-(13-methyltetradecanoyl)-2-(11-methyldodecanoyl)-3-heneicosanoyl-sn-glycerol

Properties Image MNX_ID MNXM212166 reference slm:000142344 formula C52H100O6 global charge 0 mol weight 821.366 InChIKey FIPNVYYEVBZLQL-GGCSAXROSA-N InChI InChI=1S/C52H100O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27-32-37-42-50(53)56-45-49(58-52(55)44-39-34-29-24-26-31-36-41-48(4)5)46-57-51(54)43-38-33-28-23-20-21-25-30-35-40-47(2)3/h47-49H,6-46H2,1-5H3/t49-/m0/s1 SMILES CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C52H100O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27-32-37-42-50(53)56-45-49(58-52(55)44-39-34-29-24-26-31-36-41-48(4)5)46-57-51(54)43-38-33-28-23-20-21-25-30-35-40-47(2)3/h47-49H,6-46H2,1-5H3/t49-/m0/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:22][CH2:27][CH2:32][CH2:37][CH2:42][C:50](=[O:53])[O:56][CH2:45][C@@H:49]([CH2:46][O:57][C:51]([CH2:43][CH2:38][CH2:33][CH2:28][CH2:23][CH2:20][CH2:21][CH2:25][CH2:30][CH2:35][CH2:40][CH:47]([CH3:2])[CH3:3])=[O:54])[O:58][C:52]([CH2:44][CH2:39][CH2:34][CH2:29][CH2:24][CH2:26][CH2:31][CH2:36][CH2:41][CH:48]([CH3:4])[CH3:5])=[O:55]

Parent-child relations graph

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