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1,3-didodecanoyl-2-docosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM178769 Image of MNXM178769
referenceslm:000132148
formulaC49H94O6
global charge0
mol weight779.285
InChIKeyWULKBZYJYKNGBW-UHFFFAOYSA-N
InChIInChI=1S/C49H94O6/c1-4-7-10-13-16-19-20-21-22-23-24-25-26-27-28-31-34-37-40-43-49(52)55-46(44-53-47(50)41-38-35-32-29-17-14-11-8-5-2)45-54-48(51)42-39-36-33-30-18-15-12-9-6-3/h46H,4-45H2,1-3H3
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C49H94O6/c1-4-7-10-13-16-19-20-21-22-23-24-25-26-27-28-31-34-37-40-43-49(52)55-46(44-53-47(50)41-38-35-32-29-17-14-11-8-5-2)45-54-48(51)42-39-36-33-30-18-15-12-9-6-3/h46H,4-45H2,1-3H3 Image of MNXM178769
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][C:49](=[O:52])[O:55][CH:46]([CH2:44][O:53][C:47]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:50])[CH2:45][O:54][C:48]([CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:51]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000132148
slm:000132148
WULKBZYJYKNGBW-UHFFFAOYSA-N
1,3-didodecanoyl-2-docosanoyl-sn-glycerol
TG(12:0/22:0/12:0)
Triacylglycerol (12:0/22:0/12:0)