1-(15-methylhexadecanoyl)-2-pentadecanoyl-3-tetradecanoyl-sn-glycerol

Properties Image MNX_ID MNXM230750 reference slm:000132072 formula C49H94O6 global charge 0 mol weight 779.285 InChIKey JDRZFODIXUYMLQ-DXQCBLCSSA-N InChI InChI=1S/C49H94O6/c1-5-7-9-11-13-15-17-21-26-30-34-38-42-49(52)55-46(43-53-47(50)40-36-32-28-24-19-16-14-12-10-8-6-2)44-54-48(51)41-37-33-29-25-22-18-20-23-27-31-35-39-45(3)4/h45-46H,5-44H2,1-4H3/t46-/m0/s1 SMILES CCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C49H94O6/c1-5-7-9-11-13-15-17-21-26-30-34-38-42-49(52)55-46(43-53-47(50)40-36-32-28-24-19-16-14-12-10-8-6-2)44-54-48(51)41-37-33-29-25-22-18-20-23-27-31-35-39-45(3)4/h45-46H,5-44H2,1-4H3/t46-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:21][CH2:26][CH2:30][CH2:34][CH2:38][CH2:42][C:49](=[O:52])[O:55][C@@H:46]([CH2:43][O:53][C:47]([CH2:40][CH2:36][CH2:32][CH2:28][CH2:24][CH2:19][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:50])[CH2:44][O:54][C:48]([CH2:41][CH2:37][CH2:33][CH2:29][CH2:25][CH2:22][CH2:18][CH2:20][CH2:23][CH2:27][CH2:31][CH2:35][CH2:39][CH:45]([CH3:3])[CH3:4])=[O:51]

Parent-child relations graph

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