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1,3-di-(11Z-eicosenoyl)-2-(6Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM177660 Image of MNXM177660
referenceslm:000215539
formulaC61H112O6
global charge0
mol weight941.561
InChIKeyJHFSMFHQQUPVPR-PMHXBAENSA-N
InChIInChI=1S/C61H112O6/c1-4-7-10-13-16-19-22-25-28-30-33-35-38-41-44-47-50-53-59(62)65-56-58(67-61(64)55-52-49-46-43-40-37-32-27-24-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h25-26,28-29,40,43,58H,4-24,27,30-39,41-42,44-57H2,1-3H3/b28-25-,29-26-,43-40-
SMILESCCCCCCCC/C=C\CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCC/C=C\CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C61H112O6/c1-4-7-10-13-16-19-22-25-28-30-33-35-38-41-44-47-50-53-59(62)65-56-58(67-61(64)55-52-49-46-43-40-37-32-27-24-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h25-26,28-29,40,43,58H,4-24,27,30-39,41-42,44-57H2,1-3H3/b28-25-,29-26-,43-40- Image of MNXM177660
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][CH2:56][CH:58]([CH2:57][O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:34][CH2:31]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:63])[O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:37][CH2:32][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64]
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:000215539
slm:000215539
JHFSMFHQQUPVPR-PMHXBAENSA-N
1,3-di-(11Z-eicosenoyl)-2-(6Z-octadecenoyl)-sn-glycerol
TG(20:1(11Z)/18:1(6Z)/20:1(11Z))
Triacylglycerol (20:1(11Z)/18:1(6Z)/20:1(11Z))