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1-dodecanoyl-2-(9Z-hexadecenoyl)-3-(11Z-eicosenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM109464 Image of MNXM109464
referenceslm:000136807
formulaC51H94O6
global charge0
mol weight803.307
InChIKeyYUFODVPWPWJIPV-DLDHQVKUSA-N
InChIInChI=1S/C51H94O6/c1-4-7-10-13-16-19-21-23-24-25-26-28-29-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-31-18-15-12-9-6-3)57-51(54)45-42-39-36-33-30-27-22-20-17-14-11-8-5-2/h20,22-24,48H,4-19,21,25-47H2,1-3H3/b22-20-,24-23-/t48-/m1/s1
SMILESCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C51H94O6/c1-4-7-10-13-16-19-21-23-24-25-26-28-29-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-31-18-15-12-9-6-3)57-51(54)45-42-39-36-33-30-27-22-20-17-14-11-8-5-2/h20,22-24,48H,4-19,21,25-47H2,1-3H3/b22-20-,24-23-/t48-/m1/s1 Image of MNXM109464
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:28][CH2:29][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][C:50](=[O:53])[O:56][CH2:47][C@@H:48]([CH2:46][O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:52])[O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:27]/[CH:22]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54]
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:000136807
slm:000136807
YUFODVPWPWJIPV-DLDHQVKUSA-N
1-dodecanoyl-2-(9Z-hexadecenoyl)-3-(11Z-eicosenoyl)-sn-glycerol
TG(12:0/16:1(9Z)/20:1(11Z))
Triacylglycerol (12:0/16:1(9Z)/20:1(11Z))

lipidmaps:LMGL03013359
lipidmapsM:LMGL03013359
YUFODVPWPWJIPV-DLDHQVKUSA-N
TG(12:0/16:1(9Z)/20:1(11Z))[iso6]
1-dodecanoyl-2-(9Z-hexadecenoyl)-3-(11Z-eicosenoyl)-sn-glycerol
TG 48:2
TG(12:0_16:1_20:1)
TG(48:2)