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1-(13Z-docosenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(11Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM136117 Image of MNXM136117
referenceslm:000234016
formulaC63H112O6
global charge0
mol weight965.583
InChIKeyJDJRCOJFDNTSGV-YSJNCNSWSA-N
InChIInChI=1S/C63H112O6/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/h17,20-21,24-26,28-29,36,39,60H,4-16,18-19,22-23,27,30-35,37-38,40-59H2,1-3H3/b20-17-,24-21-,28-25-,29-26-,39-36-/t60-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCC/C=C\CCCCCC)COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C63H112O6/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/h17,20-21,24-26,28-29,36,39,60H,4-16,18-19,22-23,27,30-35,37-38,40-59H2,1-3H3/b20-17-,24-21-,28-25-,29-26-,39-36-/t60-/m0/s1 Image of MNXM136117
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][CH2:43][CH2:40][CH2:37][CH2:34][CH2:27]/[CH:24]=[CH:21]\[CH2:18][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]/[CH:39]=[CH: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:000234016
slm:000234016
JDJRCOJFDNTSGV-YSJNCNSWSA-N 		1-(13Z-docosenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(11Z-octadecenoyl)-sn-glycerol
TG(22:1(13Z)/20:3(8Z,11Z,14Z)/18:1(11Z))
Triacylglycerol (22:1(13Z)/20:3(8Z,11Z,14Z)/18:1(11Z))
hmdb:HMDB0049454
JDJRCOJFDNTSGV-YSJNCNSWSA-N 		TG(18:1(11Z)/20:3n6/22:1(13Z))
(2R)-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl (13Z)-docos-13-enoate
1-(11Z-Octadecenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(13Z-docosenoyl)-glycerol
1-Vaccenoyl-2-homo-g-linolenoyl-3-erucoyl-glycerol
1-cis-Vaccenoyl-2-dihomo-gamma-linolenoyl-3-erucoyl-glycerol
TAG(18:1/20:3/22:1)
TAG(18:1/20:3W6/22:1)
TAG(18:1/20:3n6/22:1)
TAG(60:5)
TG(18:1(11Z)/20:3(8Z,11Z,14Z)/22:1(13Z))
TG(18:1/20:3/22:1)
TG(18:1/20:3W6/22:1)
TG(18:1/20:3n6/22:1)
TG(18:1W7/20:3W6/22:1W9)
TG(18:1n7/20:3n6/22:1n9)
TG(60:5)
Tag(18:1(11Z)/20:3(8Z,11Z,14Z)/22:1(13Z))
Tag(18:1W7/20:3W6/22:1W9)
Tag(18:1n7/20:3n6/22:1n9)
Tracylglycerol(18:1/20:3/22:1)
Tracylglycerol(18:1/20:3W6/22:1)
Tracylglycerol(18:1/20:3n6/22:1)
Tracylglycerol(60:5)
Triacylglycerol
Triacylglycerol(18:1(11Z)/20:3(8Z,11Z,14Z)/22:1(13Z))
Triacylglycerol(18:1/20:3/22:1)
Triacylglycerol(18:1W7/20:3W6/22:1W9)
Triacylglycerol(18:1n7/20:3n6/22:1n9)
Triacylglycerol(60:5)
Triglyceride

hmdb:HMDB49454 		secondary/obsolete/fantasy identifier