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1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(11Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM136176 Image of MNXM136176
referenceslm:000205601
formulaC61H100O6
global charge0
mol weight929.465
InChIKeyWKWRPSWSOFXGSK-VLQYAHMCSA-N
InChIInChI=1S/C61H100O6/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)67-61(64)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-21,24-26,28-29,33-34,36-37,43,46,58H,4-7,9-10,12-15,18,22-23,27,30-32,35,38-42,44-45,47-57H2,1-3H3/b11-8-,19-16-,20-17-,24-21-,28-25-,29-26-,36-33-,37-34-,46-43-/t58-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCC/C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C61H100O6/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)67-61(64)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-21,24-26,28-29,33-34,36-37,43,46,58H,4-7,9-10,12-15,18,22-23,27,30-32,35,38-42,44-45,47-57H2,1-3H3/b11-8-,19-16-,20-17-,24-21-,28-25-,29-26-,36-33-,37-34-,46-43-/t58-/m0/s1 Image of MNXM136176
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:33]=[CH:36]\[CH2:39][CH2:42][CH2:45][CH2:48][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][CH2:35][CH2:32][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:62])[O:67][C:61]([CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:40]/[CH:37]=[CH:34]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[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:000205601
slm:000205601
WKWRPSWSOFXGSK-VLQYAHMCSA-N 		1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(11Z-octadecenoyl)-sn-glycerol
TG(20:3(8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z))
Triacylglycerol (20:3(8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(11Z))
hmdb:HMDB0049627
WKWRPSWSOFXGSK-VLQYAHMCSA-N 		TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3n6)
(2S)-1-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
1-(11Z-Octadecenoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(8Z,11Z,14Z-eicosatrienoyl)-glycerol
1-Vaccenoyl-2-eicosapentaenoyl-3-homo-g-linolenoyl-glycerol
1-cis-Vaccenoyl-2-eicosapentaenoyl-3-dihomo-gamma-linolenoyl-glycerol
TAG(18:1/20:5/20:3)
TAG(18:1/20:5/20:3W6)
TAG(18:1/20:5/20:3n6)
TAG(58:9)
TG(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3(8Z,11Z,14Z))
TG(18:1/20:5/20:3)
TG(18:1/20:5/20:3W6)
TG(18:1/20:5/20:3n6)
TG(18:1W7/20:5W3/20:3W6)
TG(18:1n7/20:5n3/20:3n6)
TG(58:9)
Tag(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3(8Z,11Z,14Z))
Tag(18:1W7/20:5W3/20:3W6)
Tag(18:1n7/20:5n3/20:3n6)
Tracylglycerol(18:1/20:5/20:3)
Tracylglycerol(18:1/20:5/20:3W6)
Tracylglycerol(18:1/20:5/20:3n6)
Tracylglycerol(58:9)
Triacylglycerol
Triacylglycerol(18:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:3(8Z,11Z,14Z))
Triacylglycerol(18:1/20:5/20:3)
Triacylglycerol(18:1W7/20:5W3/20:3W6)
Triacylglycerol(18:1n7/20:5n3/20:3n6)
Triacylglycerol(58:9)
Triglyceride

hmdb:HMDB49627 		secondary/obsolete/fantasy identifier