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TG(14:1(9Z)/20:3n6/20:3(5Z,8Z,11Z))

PropertiesImage
MNX_IDMNXM132408 Image of MNXM132408
referencehmdb:HMDB0048143
formulaC57H96O6
global charge0
mol weight877.389
InChIKeyBLIUFHXTKLTTKD-AMMUJMKISA-N
InChIInChI=1S/C57H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,24-27,30-33,38,41,54H,4-14,16,19,21-23,28-29,34-37,39-40,42-53H2,1-3H3/b18-15-,20-17-,26-24-,27-25-,32-30-,33-31-,41-38-/t54-/m0/s1
SMILESCCCC/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C57H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,24-27,30-33,38,41,54H,4-14,16,19,21-23,28-29,34-37,39-40,42-53H2,1-3H3/b18-15-,20-17-,26-24-,27-25-,32-30-,33-31-,41-38-/t54-/m0/s1 Image of MNXM132408
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:35]/[CH:38]=[CH:41]\[CH2:44][CH2:47][CH2:50][C:56](=[O:59])[O:62][CH2:53][C@H:54]([CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:58])[O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60]
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
hmdb:HMDB0048143
BLIUFHXTKLTTKD-AMMUJMKISA-N 		TG(14:1(9Z)/20:3n6/20:3(5Z,8Z,11Z))
(2S)-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-3-[(9Z)-tetradec-9-enoyloxy]propyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate
1-(9Z-Tetradecenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(5Z,8Z,11Z-eicosatrienoyl)-glycerol
1-Myristoleoyl-2-dihomo-gamma-linolenoyl-3-meadoyl-glycerol
1-Myristoleoyl-2-homo-g-linolenoyl-3-meadoyl-glycerol
TAG(14:1/20:3/20:3)
TAG(14:1/20:3W6/20:3)
TAG(14:1/20:3n6/20:3)
TAG(54:7)
TG(14:1(9Z)/20:3(8Z,11Z,14Z)/20:3(5Z,8Z,11Z))
TG(14:1/20:3/20:3)
TG(14:1/20:3W6/20:3)
TG(14:1/20:3n6/20:3)
TG(14:1W5/20:3W6/20:3W9)
TG(14:1n5/20:3n6/20:3n9)
TG(54:7)
Tag(14:1(9Z)/20:3(8Z,11Z,14Z)/20:3(5Z,8Z,11Z))
Tag(14:1W5/20:3W6/20:3W9)
Tag(14:1n5/20:3n6/20:3n9)
Tracylglycerol(14:1/20:3/20:3)
Tracylglycerol(14:1/20:3W6/20:3)
Tracylglycerol(14:1/20:3n6/20:3)
Tracylglycerol(54:7)
Triacylglycerol
Triacylglycerol(14:1(9Z)/20:3(8Z,11Z,14Z)/20:3(5Z,8Z,11Z))
Triacylglycerol(14:1/20:3/20:3)
Triacylglycerol(14:1W5/20:3W6/20:3W9)
Triacylglycerol(14:1n5/20:3n6/20:3n9)
Triacylglycerol(54:7)
Triglyceride

hmdb:HMDB48143 		secondary/obsolete/fantasy identifier