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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(11Z-eicosenoyl)-3-tetradecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM131548 Image of MNXM131548
referenceslm:000188244
formulaC59H100O6
global charge0
mol weight905.443
InChIKeyCEUBQFLMBHJTAE-AINPSXNXSA-N
InChIInChI=1S/C59H100O6/c1-4-7-10-13-16-19-22-24-26-28-29-31-32-34-37-40-43-46-49-52-58(61)64-55-56(54-63-57(60)51-48-45-42-39-36-21-18-15-12-9-6-3)65-59(62)53-50-47-44-41-38-35-33-30-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,29,31,34,37,43,46,56H,4-6,8-9,11-15,17-18,20-23,28,30,32-33,35-36,38-42,44-45,47-55H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,31-29-,37-34-,46-43-/t56-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C59H100O6/c1-4-7-10-13-16-19-22-24-26-28-29-31-32-34-37-40-43-46-49-52-58(61)64-55-56(54-63-57(60)51-48-45-42-39-36-21-18-15-12-9-6-3)65-59(62)53-50-47-44-41-38-35-33-30-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,29,31,34,37,43,46,56H,4-6,8-9,11-15,17-18,20-23,28,30,32-33,35-36,38-42,44-45,47-55H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,31-29-,37-34-,46-43-/t56-/m0/s1 Image of MNXM131548
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:29]=[CH:31]\[CH2:32]/[CH:34]=[CH:37]\[CH2:40]/[CH:43]=[CH: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][CH2:36][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:60])[O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:33][CH2:30]/[CH:27]=[CH:25]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[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

SLM:000188244
slm:000188244
CEUBQFLMBHJTAE-AINPSXNXSA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(11Z-eicosenoyl)-3-tetradecanoyl-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:1(11Z)/14:0)
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:1(11Z)/14:0)
hmdb:HMDB0042419
CEUBQFLMBHJTAE-AINPSXNXSA-N 		TG(14:0/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-[(11Z)-icos-11-enoyloxy]-3-(tetradecanoyloxy)propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-Myristoyl-2-eicosenoyl-3-docosahexaenoyl-glycerol
1-Tetradecanoyl-2-(11-eicosenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
TAG(14:0/20:1/22:6)
TAG(56:7)
TG(14:0/20:1/22:6)
TG(56:7)
Tracylglycerol(14:0/20:1/22:6)
Tracylglycerol(56:7)
Triacylglycerol
Triglyceride

hmdb:HMDB42419 		secondary/obsolete/fantasy identifier