1,2-di-(11-methyldodecanoyl)-3-tridecanoyl-sn-glycerol

Properties Image MNX_ID MNXM174477 reference slm:000123898 formula C42H80O6 global charge 0 mol weight 681.096 InChIKey NASFDCZYXWAITA-KDXMTYKHSA-N InChI InChI=1S/C42H80O6/c1-6-7-8-9-10-11-12-17-22-27-32-40(43)46-35-39(48-42(45)34-29-24-19-14-16-21-26-31-38(4)5)36-47-41(44)33-28-23-18-13-15-20-25-30-37(2)3/h37-39H,6-36H2,1-5H3/t39-/m0/s1 SMILES CCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C42H80O6/c1-6-7-8-9-10-11-12-17-22-27-32-40(43)46-35-39(48-42(45)34-29-24-19-14-16-21-26-31-38(4)5)36-47-41(44)33-28-23-18-13-15-20-25-30-37(2)3/h37-39H,6-36H2,1-5H3/t39-/m0/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:17][CH2:22][CH2:27][CH2:32][C:40](=[O:43])[O:46][CH2:35][C@@H:39]([CH2:36][O:47][C:41]([CH2:33][CH2:28][CH2:23][CH2:18][CH2:13][CH2:15][CH2:20][CH2:25][CH2:30][CH:37]([CH3:2])[CH3:3])=[O:44])[O:48][C:42]([CH2:34][CH2:29][CH2:24][CH2:19][CH2:14][CH2:16][CH2:21][CH2:26][CH2:31][CH:38]([CH3:4])[CH3:5])=[O:45]

Parent-child relations graph

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