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

PropertiesImage
MNX_IDMNXM124626 Image of MNXM124626
referenceslm:000124472
formulaC45H72O5
global charge0
mol weight693.066
InChIKeyXIIMRDYOTHGJCI-QJWQWIMRSA-N
InChIInChI=1S/C45H72O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(48)50-42-43(46)41-49-44(47)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,22,24,28,30,34,36,43,46H,3-4,6,8-10,15-16,21,23,25-27,29,31-33,35,37-42H2,1-2H3/b7-5-,13-11-,14-12-,19-17-,20-18-,24-22-,30-28-,36-34-/t43-/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)CCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C45H72O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(48)50-42-43(46)41-49-44(47)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,22,24,28,30,34,36,43,46H,3-4,6,8-10,15-16,21,23,25-27,29,31-33,35,37-42H2,1-2H3/b7-5-,13-11-,14-12-,19-17-,20-18-,24-22-,30-28-,36-34-/t43-/m1/s1 Image of MNXM124626
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:34]=[CH:36]\[CH2:38][CH2:40][C:45](=[O:48])[O:50][CH2:42][C@@H:43]([CH2:41][O:49][C:44]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:47])[OH:46]
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:000124472
slm:000124472
XIIMRDYOTHGJCI-QJWQWIMRSA-N 		1-(11Z,14Z-eicosadienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol
DG(20:2(11Z,14Z)/0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Diacylglycerol (20:2(11Z,14Z)/0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
hmdb:HMDB0056320
XIIMRDYOTHGJCI-QJWQWIMRSA-N 		DG(20:2n6/0:0/22:6n3)
(2R)-2-Hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16,19-hexaenoic acid
(2R)-2-hydroxy-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)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol
1-Eicosadienoyl-3-docosahexaenoyl-sn-glycerol
DAG(20:2/0:0/22:6)
DAG(20:2N6/0:0/22:6N3)
DAG(20:2W6/0:0/22:6W3)
DAG(42:8)
DG(20:2/0:0/22:6)
DG(20:2W6/0:0/22:6W3)
DG(42:8)
Diacylglycerol
Diacylglycerol(20:2/0:0/22:6)
Diacylglycerol(20:2W6/0:0/22:6W3)
Diacylglycerol(20:2n6/0:0/22:6n3)
Diacylglycerol(42:8)
Diglyceride

hmdb:HMDB56320 		secondary/obsolete/fantasy identifier