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

Properties Image MNX_ID MNXM230139 reference slm:000134835 formula C50H96O6 global charge 0 mol weight 793.312 InChIKey JWGAYTAETBBZHA-MFERNQICSA-N InChI InChI=1S/C50H96O6/c1-5-7-9-11-13-15-16-17-18-19-22-26-29-33-37-41-48(51)54-44-47(56-50(53)43-39-35-31-24-14-12-10-8-6-2)45-55-49(52)42-38-34-30-27-23-20-21-25-28-32-36-40-46(3)4/h46-47H,5-45H2,1-4H3/t47-/m0/s1 SMILES CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C50H96O6/c1-5-7-9-11-13-15-16-17-18-19-22-26-29-33-37-41-48(51)54-44-47(56-50(53)43-39-35-31-24-14-12-10-8-6-2)45-55-49(52)42-38-34-30-27-23-20-21-25-28-32-36-40-46(3)4/h46-47H,5-45H2,1-4H3/t47-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:22][CH2:26][CH2:29][CH2:33][CH2:37][CH2:41][C:48](=[O:51])[O:54][CH2:44][C@@H:47]([CH2:45][O:55][C:49]([CH2:42][CH2:38][CH2:34][CH2:30][CH2:27][CH2:23][CH2:20][CH2:21][CH2:25][CH2:28][CH2:32][CH2:36][CH2:40][CH:46]([CH3:3])[CH3:4])=[O:52])[O:56][C:50]([CH2:43][CH2:39][CH2:35][CH2:31][CH2:24][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:53]

Parent-child relations graph

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