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

PropertiesImage
MNX_IDMNXM142400 Image of MNXM142400
referenceslm:000262711
formulaC67H110O6
global charge0
mol weight1011.611
InChIKeyOCGQVKCGHZXWOR-XOYZTKHWSA-N
InChIInChI=1S/C67H110O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-38-41-44-47-50-53-56-59-65(68)71-62-64(73-67(70)61-58-55-52-49-46-43-40-35-30-27-24-21-18-15-12-9-6-3)63-72-66(69)60-57-54-51-48-45-42-39-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25-30,33,36,40-41,43-44,50,53,64H,4-6,8-9,11-15,17,20,22-24,31-32,34-35,37-39,42,45-49,51-52,54-63H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,29-26-,30-27-,36-33-,43-40-,44-41-,53-50-/t64-/m1/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)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C67H110O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-38-41-44-47-50-53-56-59-65(68)71-62-64(73-67(70)61-58-55-52-49-46-43-40-35-30-27-24-21-18-15-12-9-6-3)63-72-66(69)60-57-54-51-48-45-42-39-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25-30,33,36,40-41,43-44,50,53,64H,4-6,8-9,11-15,17,20,22-24,31-32,34-35,37-39,42,45-49,51-52,54-63H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,29-26-,30-27-,36-33-,43-40-,44-41-,53-50-/t64-/m1/s1 Image of MNXM142400
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:33]=[CH:36]\[CH2:38]/[CH:41]=[CH:44]\[CH2:47]/[CH:50]=[CH:53]\[CH2:56][CH2:59][C:65](=[O:68])[O:71][CH2:62][C@H:64]([CH2:63][O:72][C:66]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:37][CH2:34][CH2:32]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:69])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:35]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70]
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:000262711
slm:000262711
OCGQVKCGHZXWOR-XOYZTKHWSA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(13Z-docosenoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(8Z,11Z,14Z)/22:1(13Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(8Z,11Z,14Z)/22:1(13Z))
hmdb:HMDB0051729
OCGQVKCGHZXWOR-XOYZTKHWSA-N 		TG(22:1(13Z)/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-3-[(13Z)-docos-13-enoyloxy]-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(13Z-Docosenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-Erucoyl-2-dihomo-gamma-linolenoyl-3-docosahexaenoyl-glycerol
1-Erucoyl-2-homo-g-linolenoyl-3-docosahexaenoyl-glycerol
TAG(22:1/20:3/22:6)
TAG(22:1/20:3W6/22:6)
TAG(22:1/20:3n6/22:6)
TAG(64:10)
TG(22:1(13Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
TG(22:1/20:3/22:6)
TG(22:1/20:3W6/22:6)
TG(22:1/20:3n6/22:6)
TG(22:1W9/20:3W6/22:6W3)
TG(22:1n9/20:3n6/22:6n3)
TG(64:10)
Tag(22:1(13Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Tag(22:1W9/20:3W6/22:6W3)
Tag(22:1n9/20:3n6/22:6n3)
Tracylglycerol(22:1/20:3/22:6)
Tracylglycerol(22:1/20:3W6/22:6)
Tracylglycerol(22:1/20:3n6/22:6)
Tracylglycerol(64:10)
Triacylglycerol
Triacylglycerol(22:1(13Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Triacylglycerol(22:1/20:3/22:6)
Triacylglycerol(22:1W9/20:3W6/22:6W3)
Triacylglycerol(22:1n9/20:3n6/22:6n3)
Triacylglycerol(64:10)
Triglyceride

hmdb:HMDB51729 		secondary/obsolete/fantasy identifier