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1,3-di-(11Z-octadecenoyl)-2-docosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM136188 Image of MNXM136188
referenceslm:000216771
formulaC61H114O6
global charge0
mol weight943.577
InChIKeyRKIWUSSRNOMOHK-XFUYORNGSA-N
InChIInChI=1S/C61H114O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-34-37-40-43-46-49-52-55-61(64)67-58(56-65-59(62)53-50-47-44-41-38-35-32-26-23-20-17-14-11-8-5-2)57-66-60(63)54-51-48-45-42-39-36-33-27-24-21-18-15-12-9-6-3/h20-21,23-24,58H,4-19,22,25-57H2,1-3H3/b23-20-,24-21-
SMILESCCCCCC/C=C\CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C61H114O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-34-37-40-43-46-49-52-55-61(64)67-58(56-65-59(62)53-50-47-44-41-38-35-32-26-23-20-17-14-11-8-5-2)57-66-60(63)54-51-48-45-42-39-36-33-27-24-21-18-15-12-9-6-3/h20-21,23-24,58H,4-19,22,25-57H2,1-3H3/b23-20-,24-21- Image of MNXM136188
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:29][CH2:30][CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][C:61](=[O:64])[O:67][CH:58]([CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[CH2:57][O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:63]
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:000216771
slm:000216771
RKIWUSSRNOMOHK-XFUYORNGSA-N
1,3-di-(11Z-octadecenoyl)-2-docosanoyl-sn-glycerol
TG(18:1(11Z)/22:0/18:1(11Z))
Triacylglycerol (18:1(11Z)/22:0/18:1(11Z))
hmdb:HMDB0049177
RKIWUSSRNOMOHK-XFUYORNGSA-N
TG(18:1(11Z)/22:0/18:1(11Z))
1,3-bis[(11Z)-octadec-11-enoyloxy]propan-2-yl docosanoate
1-(11Z-Octadecenoyl)-2-docosanoyl-3-(11Z-octadecenoyl)-glycerol
1-Vaccenoyl-2-behenoyl-3-vaccenoyl-glycerol
TAG(18:1/22:0/18:1)
TAG(58:2)
TG(18:1/22:0/18:1)
TG(58:2)
Tracylglycerol(18:1/22:0/18:1)
Tracylglycerol(58:2)
Triacylglycerol
Triglyceride

hmdb:HMDB49177
secondary/obsolete/fantasy identifier