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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(11Z,14Z-eicosadienoyl)-3-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM140945 Image of MNXM140945
referenceslm:000241945
formulaC65H102O6
global charge0
mol weight979.525
InChIKeyPPOTXXPYDKRBFX-XGGWUGDISA-N
InChIInChI=1S/C65H102O6/c1-4-7-10-13-16-19-22-25-28-31-32-35-37-40-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-41-38-34-30-27-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16-21,25-30,32,35-36,39-40,43,45,48-49,52,62H,4-6,8-9,11-15,22-24,31,33-34,37-38,41-42,44,46-47,50-51,53-61H2,1-3H3/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-32-,39-36-,43-40-,48-45-,52-49-/t62-/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)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C65H102O6/c1-4-7-10-13-16-19-22-25-28-31-32-35-37-40-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-41-38-34-30-27-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16-21,25-30,32,35-36,39-40,43,45,48-49,52,62H,4-6,8-9,11-15,22-24,31,33-34,37-38,41-42,44,46-47,50-51,53-61H2,1-3H3/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-32-,39-36-,43-40-,48-45-,52-49-/t62-/m0/s1 Image of MNXM140945
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:32]=[CH:35]\[CH2:37]/[CH:40]=[CH:43]\[CH2:46]/[CH:49]=[CH:52]\[CH2:55][CH2:58][C:64](=[O:67])[O:70][CH2:61][C@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54][CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:36]\[CH2:33]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66])[O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:34]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:68]
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:000241945
slm:000241945
PPOTXXPYDKRBFX-XGGWUGDISA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(11Z,14Z-eicosadienoyl)-3-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z))
hmdb:HMDB0054208
PPOTXXPYDKRBFX-XGGWUGDISA-N 		TG(20:4(5Z,8Z,11Z,14Z)/20:2n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-[(11Z,14Z)-icosa-11,14-dienoyloxy]-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(5Z,8Z,11Z,14Z-Eicosatetraenoyl)-2-(11Z,14Z-eicosadienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-Arachidonoyl-2-eicosadienoyl-3-docosahexaenoyl-glycerol
TAG(20:4/20:2/22:6)
TAG(20:4/20:2W6/22:6)
TAG(20:4/20:2n6/22:6)
TAG(62:12)
TG(20:4(5Z,8Z,11Z,14Z)/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
TG(20:4/20:2/22:6)
TG(20:4/20:2W6/22:6)
TG(20:4/20:2n6/22:6)
TG(20:4W6/20:2W6/22:6W3)
TG(20:4n6/20:2n6/22:6n3)
TG(62:12)
Tag(20:4(5Z,8Z,11Z,14Z)/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Tag(20:4W6/20:2W6/22:6W3)
Tag(20:4n6/20:2n6/22:6n3)
Tracylglycerol(20:4/20:2/22:6)
Tracylglycerol(20:4/20:2W6/22:6)
Tracylglycerol(20:4/20:2n6/22:6)
Tracylglycerol(62:12)
Triacylglycerol
Triacylglycerol(20:4(5Z,8Z,11Z,14Z)/20:2(11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Triacylglycerol(20:4/20:2/22:6)
Triacylglycerol(20:4W6/20:2W6/22:6W3)
Triacylglycerol(20:4n6/20:2n6/22:6n3)
Triacylglycerol(62:12)
Triglyceride

hmdb:HMDB54208 		secondary/obsolete/fantasy identifier