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1-(9Z-hexadecenoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-eicosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM138660 Image of MNXM138660
referenceslm:000190321
formulaC59H102O6
global charge0
mol weight907.459
InChIKeyRNBFKHXEHREDML-WWZSYUGTSA-N
InChIInChI=1S/C59H102O6/c1-4-7-10-13-16-19-22-25-27-29-31-34-37-40-43-46-49-52-58(61)64-55-56(54-63-57(60)51-48-45-42-39-36-33-24-21-18-15-12-9-6-3)65-59(62)53-50-47-44-41-38-35-32-30-28-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,28,32,35,41,44,56H,4-7,9-10,12-16,18-19,22-23,25,27,29-31,33-34,36-40,42-43,45-55H2,1-3H3/b11-8-,20-17-,24-21-,28-26-,35-32-,44-41-/t56-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C59H102O6/c1-4-7-10-13-16-19-22-25-27-29-31-34-37-40-43-46-49-52-58(61)64-55-56(54-63-57(60)51-48-45-42-39-36-33-24-21-18-15-12-9-6-3)65-59(62)53-50-47-44-41-38-35-32-30-28-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,28,32,35,41,44,56H,4-7,9-10,12-16,18-19,22-23,25,27,29-31,33-34,36-40,42-43,45-55H2,1-3H3/b11-8-,20-17-,24-21-,28-26-,35-32-,44-41-/t56-/m1/s1 Image of MNXM138660
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:31][CH2:34][CH2:37][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][CH2:36][CH2:33]/[CH:24]=[CH: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]/[CH:44]=[CH:41]\[CH2:38]/[CH:35]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH: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:000190321
slm:000190321
RNBFKHXEHREDML-WWZSYUGTSA-N
1-(9Z-hexadecenoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-eicosanoyl-sn-glycerol
TG(16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:0)
Triacylglycerol (16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:0)
hmdb:HMDB0046157
RNBFKHXEHREDML-WWZSYUGTSA-N
TG(20:0/20:5(5Z,8Z,11Z,14Z,17Z)/16:1(9Z))
(2S)-1-[(9Z)-hexadec-9-enoyloxy]-3-(icosanoyloxy)propan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
1-Arachidonyl-2-eicosapentaenoyl-3-palmitoleoyl-glycerol
1-Eicosanoyl-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(9Z-hexadecenoyl)-glycerol
TAG(20:0/20:5/16:1)
TAG(56:6)
TG(20:0/20:5/16:1)
TG(56:6)
Tracylglycerol(20:0/20:5/16:1)
Tracylglycerol(56:6)
Triacylglycerol
Triglyceride

hmdb:HMDB46157
secondary/obsolete/fantasy identifier