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1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11Z,14Z-eicosadienoyl)-3-(13Z-docosenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM142353 Image of MNXM142353
referenceslm:000232524
formulaC63H110O6
global charge0
mol weight963.567
InChIKeyVDRHQUDGPLPDPR-HXPJWBRTSA-N
InChIInChI=1S/C63H110O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,25-29,34,40,43,60H,4-16,19,22-24,30-33,35-39,41-42,44-59H2,1-3H3/b20-17-,21-18-,28-25-,29-26-,34-27-,43-40-/t60-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C63H110O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,25-29,34,40,43,60H,4-16,19,22-24,30-33,35-39,41-42,44-59H2,1-3H3/b20-17-,21-18-,28-25-,29-26-,34-27-,43-40-/t60-/m1/s1 Image of MNXM142353
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:31][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:37]/[CH:34]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66]
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:000232524
slm:000232524
VDRHQUDGPLPDPR-HXPJWBRTSA-N 		1-(6Z,9Z,12Z-octadecatrienoyl)-2-(11Z,14Z-eicosadienoyl)-3-(13Z-docosenoyl)-sn-glycerol
TG(18:3(6Z,9Z,12Z)/20:2(11Z,14Z)/22:1(13Z))
Triacylglycerol (18:3(6Z,9Z,12Z)/20:2(11Z,14Z)/22:1(13Z))
hmdb:HMDB0051700
VDRHQUDGPLPDPR-HXPJWBRTSA-N 		TG(22:1(13Z)/20:2n6/18:3(6Z,9Z,12Z))
(2S)-2-[(11Z,14Z)-icosa-11,14-dienoyloxy]-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl (13Z)-docos-13-enoate
1-(13Z-Docosenoyl)-2-(11Z,14Z-eicosadienoyl)-3-(6Z,9Z,12Z-octadecatrienoyl)-glycerol
1-Erucoyl-2-eicosadienoyl-3-g-linolenoyl-glycerol
1-Erucoyl-2-eicosadienoyl-3-gamma-linolenoyl-glycerol
TAG(22:1/20:2/18:3)
TAG(22:1/20:2W6/18:3)
TAG(22:1/20:2n6/18:3)
TAG(60:6)
TG(22:1(13Z)/20:2(11Z,14Z)/18:3(6Z,9Z,12Z))
TG(22:1/20:2/18:3)
TG(22:1/20:2W6/18:3)
TG(22:1/20:2n6/18:3)
TG(22:1W9/20:2W6/18:3W6)
TG(22:1n9/20:2n6/18:3n6)
TG(60:6)
Tag(22:1(13Z)/20:2(11Z,14Z)/18:3(6Z,9Z,12Z))
Tag(22:1W9/20:2W6/18:3W6)
Tag(22:1n9/20:2n6/18:3n6)
Tracylglycerol(22:1/20:2/18:3)
Tracylglycerol(22:1/20:2W6/18:3)
Tracylglycerol(22:1/20:2n6/18:3)
Tracylglycerol(60:6)
Triacylglycerol
Triacylglycerol(22:1(13Z)/20:2(11Z,14Z)/18:3(6Z,9Z,12Z))
Triacylglycerol(22:1/20:2/18:3)
Triacylglycerol(22:1W9/20:2W6/18:3W6)
Triacylglycerol(22:1n9/20:2n6/18:3n6)
Triacylglycerol(60:6)
Triglyceride

hmdb:HMDB51700 		secondary/obsolete/fantasy identifier