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TG(22:1(13Z)/14:1(9Z)/20:3n6)

PropertiesImage
MNX_IDMNXM142136 Image of MNXM142136
referencechebi:171302
formulaC59H104O6
global charge0
mol weight909.475
InChIKeyRSSVAUCMKSOSJP-FXRYJFAKSA-N
InChIInChI=1S/C59H104O6/c1-4-7-10-13-16-19-22-24-26-28-29-31-33-35-38-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-36-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-37-34-32-30-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,24-27,32,34,56H,4-14,16,19,21-23,28-31,33,35-55H2,1-3H3/b18-15-,20-17-,26-24-,27-25-,34-32-/t56-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C59H104O6/c1-4-7-10-13-16-19-22-24-26-28-29-31-33-35-38-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-36-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-37-34-32-30-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,24-27,32,34,56H,4-14,16,19,21-23,28-31,33,35-55H2,1-3H3/b18-15-,20-17-,26-24-,27-25-,34-32-/t56-/m1/s1 Image of MNXM142136
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:24]=[CH:26]\[CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:38][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][C:58](=[O:61])[O:64][CH2:55][C@@H:56]([CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:37]/[CH:34]=[CH:32]\[CH2:30]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:36][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:62]
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

CHEBI:171302
chebi:171302
RSSVAUCMKSOSJP-FXRYJFAKSA-N 		TG(22:1(13Z)/14:1(9Z)/20:3n6)
[(2S)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] (Z)-docos-13-enoate

SLM:000190994
slm:000190994
RSSVAUCMKSOSJP-FXRYJFAKSA-N 		1-(8Z,11Z,14Z-eicosatrienoyl)-2-(9Z-tetradecenoyl)-3-(13Z-docosenoyl)-sn-glycerol
TG(20:3(8Z,11Z,14Z)/14:1(9Z)/22:1(13Z))
Triacylglycerol (20:3(8Z,11Z,14Z)/14:1(9Z)/22:1(13Z))
hmdb:HMDB0051532
RSSVAUCMKSOSJP-FXRYJFAKSA-N 		TG(22:1(13Z)/14:1(9Z)/20:3n6)
(2S)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-2-[(9Z)-tetradec-9-enoyloxy]propyl (13Z)-docos-13-enoate
1-(13Z-Docosenoyl)-2-(9Z-tetradecenoyl)-3-(8Z,11Z,14Z-eicosatrienoyl)-glycerol
1-Erucoyl-2-myristoleoyl-3-dihomo-gamma-linolenoyl-glycerol
1-Erucoyl-2-myristoleoyl-3-homo-g-linolenoyl-glycerol
TAG(22:1/14:1/20:3)
TAG(22:1/14:1/20:3W6)
TAG(22:1/14:1/20:3n6)
TAG(56:5)
TG(22:1(13Z)/14:1(9Z)/20:3(8Z,11Z,14Z))
TG(22:1/14:1/20:3)
TG(22:1/14:1/20:3W6)
TG(22:1/14:1/20:3n6)
TG(22:1W9/14:1W5/20:3W6)
TG(22:1n9/14:1n5/20:3n6)
TG(56:5)
Tag(22:1(13Z)/14:1(9Z)/20:3(8Z,11Z,14Z))
Tag(22:1W9/14:1W5/20:3W6)
Tag(22:1n9/14:1n5/20:3n6)
Tracylglycerol(22:1/14:1/20:3)
Tracylglycerol(22:1/14:1/20:3W6)
Tracylglycerol(22:1/14:1/20:3n6)
Tracylglycerol(56:5)
Triacylglycerol
Triacylglycerol(22:1(13Z)/14:1(9Z)/20:3(8Z,11Z,14Z))
Triacylglycerol(22:1/14:1/20:3)
Triacylglycerol(22:1W9/14:1W5/20:3W6)
Triacylglycerol(22:1n9/14:1n5/20:3n6)
Triacylglycerol(56:5)
Triglyceride

hmdb:HMDB51532 		secondary/obsolete/fantasy identifier