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1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-hexadecanoyl-3-docosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM141455 Image of MNXM141455
referenceslm:000212754
formulaC61H108O6
global charge0
mol weight937.529
InChIKeyUNTAVUUXPMFYJY-PNSUGIGNSA-N
InChIInChI=1S/C61H108O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-37-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-33-31-28-26-23-20-17-14-11-8-5-2/h8,11,17,20,26,28,33,36,41,44,58H,4-7,9-10,12-16,18-19,21-25,27,29-32,34-35,37-40,42-43,45-57H2,1-3H3/b11-8-,20-17-,28-26-,36-33-,44-41-/t58-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C61H108O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-37-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-36-33-31-28-26-23-20-17-14-11-8-5-2/h8,11,17,20,26,28,33,36,41,44,58H,4-7,9-10,12-16,18-19,21-25,27,29-32,34-35,37-40,42-43,45-57H2,1-3H3/b11-8-,20-17-,28-26-,36-33-,44-41-/t58-/m1/s1 Image of MNXM141455
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:30][CH2:32][CH2:34][CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][C:60](=[O:63])[O:66][CH2:57][C@@H:58]([CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47]/[CH:44]=[CH:41]\[CH2:38]/[CH:36]=[CH:33]\[CH2:31]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:62])[O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:35][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64]
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:000212754
slm:000212754
UNTAVUUXPMFYJY-PNSUGIGNSA-N 		1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-hexadecanoyl-3-docosanoyl-sn-glycerol
TG(20:5(5Z,8Z,11Z,14Z,17Z)/16:0/22:0)
Triacylglycerol (20:5(5Z,8Z,11Z,14Z,17Z)/16:0/22:0)
hmdb:HMDB0046327
UNTAVUUXPMFYJY-PNSUGIGNSA-N 		TG(22:0/16:0/20:5(5Z,8Z,11Z,14Z,17Z))
(2S)-2-(hexadecanoyloxy)-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]propyl docosanoate
1-Behenoyl-2-palmitoyl-3-eicosapentaenoyl-glycerol
1-Docosanoyl-2-hexadecanoyl-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-glycerol
TAG(22:0/16:0/20:5)
TAG(58:5)
TG(22:0/16:0/20:5)
TG(58:5)
Tracylglycerol(22:0/16:0/20:5)
Tracylglycerol(58:5)
Triacylglycerol
Triglyceride

hmdb:HMDB46327 		secondary/obsolete/fantasy identifier