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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-3-(11Z,14Z-eicosadienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM139820 Image of MNXM139820
referenceslm:000259940
formulaC67H106O6
global charge0
mol weight1007.579
InChIKeyQIIOPFFAWPCRMB-JPVHHGKFSA-N
InChIInChI=1S/C67H106O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,10,16-21,25-30,33-34,36-37,42-43,45-46,51,54,64H,4-6,8-9,11-15,22-24,31-32,35,38-41,44,47-50,52-53,55-63H2,1-3H3/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-33-,37-34-,45-42-,46-43-,54-51-/t64-/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)CCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C67H106O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7,10,16-21,25-30,33-34,36-37,42-43,45-46,51,54,64H,4-6,8-9,11-15,22-24,31-32,35,38-41,44,47-50,52-53,55-63H2,1-3H3/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-33-,37-34-,45-42-,46-43-,54-51-/t64-/m0/s1 Image of MNXM139820
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:33]=[CH:36]\[CH2:39]/[CH:42]=[CH:45]\[CH2:48]/[CH:51]=[CH:54]\[CH2:57][CH2:60][C:66](=[O:69])[O:72][CH2:63][C@H:64]([CH2:62][O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:40]/[CH:37]=[CH:34]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:70]
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:000259940
slm:000259940
QIIOPFFAWPCRMB-JPVHHGKFSA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-3-(11Z,14Z-eicosadienoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z))
hmdb:HMDB0053548
QIIOPFFAWPCRMB-JPVHHGKFSA-N 		TG(20:2n6/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyloxy]-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(11Z,14Z-Eicosadienoyl)-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-Eicosadienoyl-2-adrenoyl-3-docosahexaenoyl-glycerol
TAG(20:2/22:4/22:6)
TAG(20:2W6/22:4/22:6)
TAG(20:2n6/22:4/22:6)
TAG(64:12)
TG(20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
TG(20:2/22:4/22:6)
TG(20:2W6/22:4/22:6)
TG(20:2W6/22:4W6/22:6W3)
TG(20:2n6/22:4/22:6)
TG(20:2n6/22:4n6/22:6n3)
TG(64:12)
Tag(20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Tag(20:2W6/22:4W6/22:6W3)
Tag(20:2n6/22:4n6/22:6n3)
Tracylglycerol(20:2/22:4/22:6)
Tracylglycerol(20:2W6/22:4/22:6)
Tracylglycerol(20:2n6/22:4/22:6)
Tracylglycerol(64:12)
Triacylglycerol
Triacylglycerol(20:2(11Z,14Z)/22:4(7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Triacylglycerol(20:2/22:4/22:6)
Triacylglycerol(20:2W6/22:4W6/22:6W3)
Triacylglycerol(20:2n6/22:4n6/22:6n3)
Triacylglycerol(64:12)
Triglyceride

hmdb:HMDB53548 		secondary/obsolete/fantasy identifier