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1,3-dioctacosanoyl-2-(11-methyldodecanoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM179055 Image of MNXM179055
referenceslm:000296811
formulaC72H140O6
global charge0
mol weight1101.906
InChIKeyLIKBECWUFKCAQU-UHFFFAOYSA-N
InChIInChI=1S/C72H140O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-51-55-59-63-70(73)76-66-69(78-72(75)65-61-57-53-49-50-54-58-62-68(3)4)67-77-71(74)64-60-56-52-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h68-69H,5-67H2,1-4H3
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C72H140O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-51-55-59-63-70(73)76-66-69(78-72(75)65-61-57-53-49-50-54-58-62-68(3)4)67-77-71(74)64-60-56-52-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h68-69H,5-67H2,1-4H3 Image of MNXM179055
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:51][CH2:55][CH2:59][CH2:63][C:70](=[O:73])[O:76][CH2:66][CH:69]([CH2:67][O:77][C:71]([CH2:64][CH2:60][CH2:56][CH2:52][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:74])[O:78][C:72]([CH2:65][CH2:61][CH2:57][CH2:53][CH2:49][CH2:50][CH2:54][CH2:58][CH2:62][CH:68]([CH3:3])[CH3:4])=[O:75]
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:000296811
slm:000296811
LIKBECWUFKCAQU-UHFFFAOYSA-N
1,3-dioctacosanoyl-2-(11-methyldodecanoyl)-sn-glycerol
TG(28:0/13:0/28:0)
Triacylglycerol (28:0/13:0/28:0)