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1,3-di-(8Z,11Z,14Z,17Z-eicosatetraenoyl)-2-dodecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM178324 Image of MNXM178324
referenceslm:000152314
formulaC55H90O6
global charge0
mol weight847.319
InChIKeyJFBQKVILPFZDAT-KNCAQREASA-N
InChIInChI=1S/C55H90O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-36-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-35-18-15-12-9-6-3)51-60-54(57)48-45-42-39-37-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-20,23-26,29-32,52H,4-6,9,12-15,18,21-22,27-28,33-51H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,25-23-,26-24-,31-29-,32-30-
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OCC(COC(=O)CCCCCC/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C55H90O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-36-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-35-18-15-12-9-6-3)51-60-54(57)48-45-42-39-37-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-20,23-26,29-32,52H,4-6,9,12-15,18,21-22,27-28,33-51H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,25-23-,26-24-,31-29-,32-30- Image of MNXM178324
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][CH2:50][CH:52]([CH2:51][O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:37][CH2:34]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:57])[O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:35][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:58]
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:000152314
slm:000152314
JFBQKVILPFZDAT-KNCAQREASA-N
1,3-di-(8Z,11Z,14Z,17Z-eicosatetraenoyl)-2-dodecanoyl-sn-glycerol
TG(20:4(8Z,11Z,14Z,17Z)/12:0/20:4(8Z,11Z,14Z,17Z))
Triacylglycerol (20:4(8Z,11Z,14Z,17Z)/12:0/20:4(8Z,11Z,14Z,17Z))