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1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(13Z-docosenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM142495 Image of MNXM142495
referenceslm:000264998
formulaC67H114O6
global charge0
mol weight1015.643
InChIKeyNWJBECSQGANKRW-MECXFXGGSA-N
InChIInChI=1S/C67H114O6/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/h9,12,17-18,20-21,25-30,38,41,47,50,64H,4-8,10-11,13-16,19,22-24,31-37,39-40,42-46,48-49,51-63H2,1-3H3/b12-9-,20-17-,21-18-,28-25-,29-26-,30-27-,41-38-,50-47-/t64-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C67H114O6/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/h9,12,17-18,20-21,25-30,38,41,47,50,64H,4-8,10-11,13-16,19,22-24,31-37,39-40,42-46,48-49,51-63H2,1-3H3/b12-9-,20-17-,21-18-,28-25-,29-26-,30-27-,41-38-,50-47-/t64-/m1/s1 Image of MNXM142495
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][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]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH: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:000264998
slm:000264998
NWJBECSQGANKRW-MECXFXGGSA-N
1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(13Z-docosenoyl)-sn-glycerol
TG(20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)/22:1(13Z))
Triacylglycerol (20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)/22:1(13Z))
hmdb:HMDB0051761
NWJBECSQGANKRW-MECXFXGGSA-N
TG(22:1(13Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z))
(2S)-1-[(13Z)-docos-13-enoyloxy]-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]propan-2-yl (13Z,16Z)-docosa-13,16-dienoate
1-(13Z-Docosenoyl)-2-(13Z,16Z-docosadienoyl)-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-glycerol
1-Erucoyl-2-docosadienoyl-3-eicosapentaenoyl-glycerol
TAG(22:1/22:2/20:5)
TAG(64:8)
TG(22:1/22:2/20:5)
TG(64:8)
Tracylglycerol(22:1/22:2/20:5)
Tracylglycerol(64:8)
Triacylglycerol
Triglyceride

hmdb:HMDB51761
secondary/obsolete/fantasy identifier