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1-(9Z,12Z,15Z-octadecatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM124553 Image of MNXM124553
referenceslm:000122764
formulaC43H66O5
global charge0
mol weight662.996
InChIKeyAVJNJRMAFJIDFI-ZYQYIVQMSA-N
InChIInChI=1S/C43H66O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(46)48-40-41(44)39-47-42(45)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-23,26,28,32,34,41,44H,3-4,9-10,15-16,20,24-25,27,29-31,33,35-40H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,23-18-,28-26-,34-32-/t41-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](O)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
MNX internals
InChI (mnx)InChI=1/C43H66O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(46)48-40-41(44)39-47-42(45)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-23,26,28,32,34,41,44H,3-4,9-10,15-16,20,24-25,27,29-31,33,35-40H2,1-2H3/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,23-18-,28-26-,34-32-/t41-/m1/s1 Image of MNXM124553
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36][CH2:38][C:43](=[O:46])[O:48][CH2:40][C@@H:41]([CH2:39][O:47][C:42]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25]/[CH:23]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:45])[OH:44]
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:000122764
slm:000122764
AVJNJRMAFJIDFI-ZYQYIVQMSA-N
1-(9Z,12Z,15Z-octadecatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol
DG(18:3(9Z,12Z,15Z)/0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Diacylglycerol (18:3(9Z,12Z,15Z)/0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
hmdb:HMDB0056371
AVJNJRMAFJIDFI-ZYQYIVQMSA-N
DG(18:3n3/0:0/22:6n3)
(2R)-2-Hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16,19-hexaenoic acid
(2R)-2-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
1-(9Z,12Z,15Z-Octadeatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol
1-a-Linolenoyl-3-docosahexaenoyl-sn-glycerol
DAG(18:3/0:0/22:6)
DAG(18:3N3/0:0/22:6N3)
DAG(18:3W3/0:0/22:6W3)
DAG(40:9)
DG(18:3/0:0/22:6)
DG(18:3W3/0:0/22:6W3)
DG(40:9)
Diacylglycerol
Diacylglycerol(18:3/0:0/22:6)
Diacylglycerol(18:3W3/0:0/22:6W3)
Diacylglycerol(18:3n3/0:0/22:6n3)
Diacylglycerol(40:9)
Diglyceride

hmdb:HMDB56371
secondary/obsolete/fantasy identifier