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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-docosanoyl-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM141329 Image of MNXM141329
referenceslm:000261335
formulaC67H108O6
global charge0
mol weight1009.595
InChIKeyXHFOHFMWFXQHSA-UGSANQLHSA-N
InChIInChI=1S/C67H108O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16,18-19,21,25,27-28,30,33,36,38,41-42,45,47,50-51,54,64H,4-6,8,11,13-15,17,20,22-24,26,29,31-32,34-35,37,39-40,43-44,46,48-49,52-53,55-63H2,1-3H3/b10-7-,12-9-,19-16-,21-18-,28-25-,30-27-,36-33-,41-38-,45-42-,50-47-,54-51-/t64-/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\C/C=C\CC)OC(=O)CCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C67H108O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16,18-19,21,25,27-28,30,33,36,38,41-42,45,47,50-51,54,64H,4-6,8,11,13-15,17,20,22-24,26,29,31-32,34-35,37,39-40,43-44,46,48-49,52-53,55-63H2,1-3H3/b10-7-,12-9-,19-16-,21-18-,28-25-,30-27-,36-33-,41-38-,45-42-,50-47-,54-51-/t64-/m0/s1 Image of MNXM141329
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]\[CH2:39]/[CH:42]=[CH:45]\[CH2:48]/[CH:51]=[CH:54]\[CH2:57][CH2:60][C:66](=[O:69])[O:72][CH2:63][C@H:64]([CH2:62][O:71][C:65]([CH2:59][CH2:56][CH2:53]/[CH:50]=[CH:47]\[CH2:44]/[CH:41]=[CH:38]\[CH2:35]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[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:000261335
slm:000261335
XHFOHFMWFXQHSA-UGSANQLHSA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-docosanoyl-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:0/20:5(5Z,8Z,11Z,14Z,17Z))
hmdb:HMDB0055707
XHFOHFMWFXQHSA-UGSANQLHSA-N 		TG(20:5(5Z,8Z,11Z,14Z,17Z)/22:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-(docosanoyloxy)-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(5Z,8Z,11Z,14Z,17Z-Eicosapentaenoyl)-2-docosanoyl-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-Eicosapentaenoyl-2-behenoyl-3-docosahexaenoyl-glycerol
TAG(20:5/22:0/22:6)
TAG(64:11)
TG(20:5/22:0/22:6)
TG(64:11)
Tracylglycerol(20:5/22:0/22:6)
Tracylglycerol(64:11)
Triacylglycerol
Triglyceride

hmdb:HMDB55707 		secondary/obsolete/fantasy identifier