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1-(6Z,9Z,12Z-octadecatrienoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-tetradecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM131861 Image of MNXM131861
referenceslm:000167609
formulaC57H94O6
global charge0
mol weight875.373
InChIKeyFIGUALCPWUZYJJ-RSMYUNEBSA-N
InChIInChI=1S/C57H94O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-30-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-30,33,35-36,38,42,45,54H,4-15,18,21-23,27,31-32,34,37,39-41,43-44,46-53H2,1-3H3/b19-16-,20-17-,26-24-,29-28-,30-25-,36-33-,38-35-,45-42-/t54-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H94O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-30-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-30,33,35-36,38,42,45,54H,4-15,18,21-23,27,31-32,34,37,39-41,43-44,46-53H2,1-3H3/b19-16-,20-17-,26-24-,29-28-,30-25-,36-33-,38-35-,45-42-/t54-/m0/s1 Image of MNXM131861
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:31]/[CH:33]=[CH:36]\[CH2:39]/[CH:42]=[CH:45]\[CH2:48][CH2:51][C:57](=[O:60])[O:63][C@@H:54]([CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:58])[CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41]/[CH:38]=[CH:35]\[CH2:32]/[CH:30]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59]
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:000167609
slm:000167609
FIGUALCPWUZYJJ-RSMYUNEBSA-N 		1-(6Z,9Z,12Z-octadecatrienoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-tetradecanoyl-sn-glycerol
TG(18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/14:0)
Triacylglycerol (18:3(6Z,9Z,12Z)/22:5(4Z,7Z,10Z,13Z,16Z)/14:0)
hmdb:HMDB0042737
FIGUALCPWUZYJJ-RSMYUNEBSA-N 		TG(14:0/22:5(4Z,7Z,10Z,13Z,16Z)/18:3(6Z,9Z,12Z))
(2S)-1-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-3-(tetradecanoyloxy)propan-2-yl (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoate
1-Myristoyl-2-osbondoyl-3-g-linolenoyl-glycerol
1-Tetradecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-3-(6Z,9Z,12Z-octadecatrienoyl)-glycerol
TAG(14:0/22:5/18:3)
TAG(54:8)
TG(14:0/22:5/18:3)
TG(54:8)
Tracylglycerol(14:0/22:5/18:3)
Tracylglycerol(54:8)
Triacylglycerol
Triglyceride

hmdb:HMDB42737 		secondary/obsolete/fantasy identifier