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1-docosanoyl-2-(11-methyldodecanoyl)-3-nonadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM346062 Image of MNXM346062
referenceslm:000178432
formulaC57H110O6
global charge0
mol weight891.501
InChIKeyQJFMYNYTXJCFGZ-XSMLMOGHSA-N
InChIInChI=1S/C57H110O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-27-29-31-33-37-41-45-49-56(59)62-52-54(63-57(60)50-46-42-38-34-35-39-43-47-53(3)4)51-61-55(58)48-44-40-36-32-30-28-26-22-20-18-16-14-12-10-8-6-2/h53-54H,5-52H2,1-4H3/t54-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C57H110O6/c1-5-7-9-11-13-15-17-19-21-23-24-25-27-29-31-33-37-41-45-49-56(59)62-52-54(63-57(60)50-46-42-38-34-35-39-43-47-53(3)4)51-61-55(58)48-44-40-36-32-30-28-26-22-20-18-16-14-12-10-8-6-2/h53-54H,5-52H2,1-4H3/t54-/m0/s1 Image of MNXM346062
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:24][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:37][CH2:41][CH2:45][CH2:49][C:56](=[O:59])[O:62][CH2:52][C@H:54]([CH2:51][O:61][C:55]([CH2:48][CH2:44][CH2:40][CH2:36][CH2:32][CH2:30][CH2:28][CH2:26][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:58])[O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:35][CH2:39][CH2:43][CH2:47][CH:53]([CH3:3])[CH3:4])=[O:60]
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:000178432
slm:000178432
QJFMYNYTXJCFGZ-XSMLMOGHSA-N
1-docosanoyl-2-(11-methyldodecanoyl)-3-nonadecanoyl-sn-glycerol
TG(22:0/13:0/19:0)
Triacylglycerol (22:0/13:0/19:0)
hmdb:HMDB0109935
QJFMYNYTXJCFGZ-XSMLMOGHSA-N
TG(19:0/i-13:0/22:0)
(2S)-2-[(11-Methyldodecanoyl)oxy]-3-(nonadecanoyloxy)propyl docosanoic acid
(2S)-2-[(11-methyldodecanoyl)oxy]-3-(nonadecanoyloxy)propyl docosanoate
1-nonadecanoyl-2-isotridecanoyl-3-behenoyl-glycerol
1-nonadecanoyl-2-isotridecanoyl-3-docosanoyl-glycerol
TAG(19:0/i-13:0/22:0)
TAG(54:0)
TG(54:0)
Tracylglycerol(19:0/i-13:0/22:0)
Tracylglycerol(54:0)
Triacylglycerol
Triglyceride