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DG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/0:0)

PropertiesImage
MNX_IDMNXM49845 Image of MNXM49845
referencechebi:89780
formulaC41H68O5
global charge0
mol weight640.99
InChIKeyXJVAEKAZSPNGNT-CTDJQAONSA-N
InChIInChI=1S/C41H68O5/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-40(43)45-38-39(37-42)46-41(44)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h12,14,17-19,21-23,26-29,39,42H,3-11,13,15-16,20,24-25,30-38H2,1-2H3/b14-12-,19-17-,21-18-,23-22-,28-26-,29-27-/t39-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](CO)COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C41H68O5/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-40(43)45-38-39(37-42)46-41(44)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h12,14,17-19,21-23,26-29,39,42H,3-11,13,15-16,20,24-25,30-38H2,1-2H3/b14-12-,19-17-,21-18-,23-22-,28-26-,29-27-/t39-/m0/s1 Image of MNXM49845
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:22]=[CH:23]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31][CH2:33][CH2:35][C:40](=[O:43])[O:45][CH2:38][C@H:39]([CH2:37][OH:42])[O:46][C:41]([CH2:36][CH2:34][CH2:32][CH2:30]/[CH:28]=[CH:26]\[CH2:24]/[CH:21]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O: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

CHEBI:89780
chebi:89780
XJVAEKAZSPNGNT-CTDJQAONSA-N
DG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/0:0)
(2S)-3-hydroxy-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate
1-Meadoyl-2-g-linolenoyl-sn-glycerol
1-Meadoyl-2-gamma-linolenoyl-sn-glycerol
DAG(20:3/18:3)
DAG(20:3n9/18:3n6)
DAG(20:3w9/18:3w6)
DAG(38:6)
DG(20:3/18:3)
DG(20:3n9/18:3n6)
DG(20:3w9/18:3w6)
DG(38:6)
Diacylglycerol
Diacylglycerol(20:3/18:3)
Diacylglycerol(20:3n9/18:3n6)
Diacylglycerol(20:3w9/18:3w6)
Diacylglycerol(38:6)
Diglyceride
hmdb:HMDB0007452
XJVAEKAZSPNGNT-CTDJQAONSA-N
DG(20:3(5Z,8Z,11Z)/18:3(6Z,9Z,12Z)/0:0)
(2S)-3-hydroxy-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl (5Z,8Z,11Z)-icosa-5,8,11-trienoate
1-(5Z,8Z,11Z-Eicosatrienoyl)-2-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycerol
1-Meadoyl-2-g-linolenoyl-sn-glycerol
1-Meadoyl-2-gamma-linolenoyl-sn-glycerol
DAG(20:3/18:3)
DAG(20:3N9/18:3N6)
DAG(20:3W9/18:3W6)
DAG(38:6)
DG(20:3/18:3)
DG(20:3N9/18:3N6)
DG(20:3W9/18:3W6)
DG(38:6)
Diacylglycerol
Diacylglycerol(20:3/18:3)
Diacylglycerol(20:3W9/18:3W6)
Diacylglycerol(20:3n9/18:3n6)
Diacylglycerol(38:6)
Diglyceride
diacylglycerol

hmdb:HMDB07452
secondary/obsolete/fantasy identifier