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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-hexadecanoyl-3-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM140484 Image of MNXM140484
referenceslm:000205403
formulaC61H100O6
global charge0
mol weight929.465
InChIKeyDCNGWQMUYHXQAS-FJYQQLEGSA-N
InChIInChI=1S/C61H100O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-37-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-33-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,30,32-33,36-37,39,45,48,58H,4-6,8-9,11-15,18,21-24,29,31,34-35,38,40-44,46-47,49-57H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-,32-30-,36-33-,39-37-,48-45-/t58-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C61H100O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-37-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-33-31-28-26-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,25-28,30,32-33,36-37,39,45,48,58H,4-6,8-9,11-15,18,21-24,29,31,34-35,38,40-44,46-47,49-57H2,1-3H3/b10-7-,19-16-,20-17-,27-25-,28-26-,32-30-,36-33-,39-37-,48-45-/t58-/m0/s1 Image of MNXM140484
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:30]=[CH:32]\[CH2:34]/[CH:37]=[CH:39]\[CH2:42]/[CH:45]=[CH:48]\[CH2:51][CH2:54][C:60](=[O:63])[O:66][CH2:57][C@H:58]([CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38]/[CH:36]=[CH:33]\[CH2:31]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:35][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:000205403
slm:000205403
DCNGWQMUYHXQAS-FJYQQLEGSA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-hexadecanoyl-3-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0/20:3(8Z,11Z,14Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:0/20:3(8Z,11Z,14Z))
hmdb:HMDB0053687
DCNGWQMUYHXQAS-FJYQQLEGSA-N 		TG(20:3n6/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-(hexadecanoyloxy)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(8Z,11Z,14Z-Eicosatrienoyl)-2-hexadecanoyl-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-Dihomo-gamma-linolenoyl-2-palmitoyl-3-docosahexaenoyl-glycerol
1-Homo-g-linolenoyl-2-palmitoyl-3-docosahexaenoyl-glycerol
TAG(20:3/16:0/22:6)
TAG(20:3W6/16:0/22:6)
TAG(20:3n6/16:0/22:6)
TAG(58:9)
TG(20:3(8Z,11Z,14Z)/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
TG(20:3/16:0/22:6)
TG(20:3W6/16:0/22:6)
TG(20:3W6/16:0/22:6W3)
TG(20:3n6/16:0/22:6)
TG(20:3n6/16:0/22:6n3)
TG(58:9)
Tag(20:3(8Z,11Z,14Z)/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Tag(20:3W6/16:0/22:6W3)
Tag(20:3n6/16:0/22:6n3)
Tracylglycerol(20:3/16:0/22:6)
Tracylglycerol(20:3W6/16:0/22:6)
Tracylglycerol(20:3n6/16:0/22:6)
Tracylglycerol(58:9)
Triacylglycerol
Triacylglycerol(20:3(8Z,11Z,14Z)/16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Triacylglycerol(20:3/16:0/22:6)
Triacylglycerol(20:3W6/16:0/22:6W3)
Triacylglycerol(20:3n6/16:0/22:6n3)
Triacylglycerol(58:9)
Triglyceride

hmdb:HMDB53687 		secondary/obsolete/fantasy identifier