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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM137905 Image of MNXM137905
referenceslm:000221621
formulaC63H98O6
global charge0
mol weight951.471
InChIKeyNLCQPRCXWUOLSI-NSMOMSTASA-N
InChIInChI=1S/C63H98O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-29,31,33-34,36,38-39,41,47,50,60H,4-6,8,11,13-15,22-24,30,32,35,37,40,42-46,48-49,51-59H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-31-,34-27-,39-36-,41-38-,50-47-/t60-/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)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C63H98O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-29,31,33-34,36,38-39,41,47,50,60H,4-6,8,11,13-15,22-24,30,32,35,37,40,42-46,48-49,51-59H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-31-,34-27-,39-36-,41-38-,50-47-/t60-/m0/s1 Image of MNXM137905
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:33]\[CH2:35]/[CH:38]=[CH:41]\[CH2:44]/[CH:47]=[CH:50]\[CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37]/[CH:34]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42]/[CH:39]=[CH:36]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66]
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:000221621
slm:000221621
NLCQPRCXWUOLSI-NSMOMSTASA-N 		1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol
TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(8Z,11Z,14Z)/18:3(9Z,12Z,15Z))
Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:3(8Z,11Z,14Z)/18:3(9Z,12Z,15Z))
hmdb:HMDB0055279
NLCQPRCXWUOLSI-NSMOMSTASA-N 		TG(18:3(9Z,12Z,15Z)/20:3n6/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2S)-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-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)-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol
1-a-Linolenoyl-2-homo-g-linolenoyl-3-docosahexaenoyl-glycerol
1-alpha-Linolenoyl-2-dihomo-gamma-linolenoyl-3-docosahexaenoyl-glycerol
TAG(18:3/20:3/22:6)
TAG(18:3/20:3W6/22:6)
TAG(18:3/20:3n6/22:6)
TAG(60:12)
TG(18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
TG(18:3/20:3/22:6)
TG(18:3/20:3W6/22:6)
TG(18:3/20:3n6/22:6)
TG(18:3W3/20:3W6/22:6W3)
TG(18:3n3/20:3n6/22:6n3)
TG(60:12)
Tag(18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Tag(18:3W3/20:3W6/22:6W3)
Tag(18:3n3/20:3n6/22:6n3)
Tracylglycerol(18:3/20:3/22:6)
Tracylglycerol(18:3/20:3W6/22:6)
Tracylglycerol(18:3/20:3n6/22:6)
Tracylglycerol(60:12)
Triacylglycerol
Triacylglycerol(18:3(9Z,12Z,15Z)/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Triacylglycerol(18:3/20:3/22:6)
Triacylglycerol(18:3W3/20:3W6/22:6W3)
Triacylglycerol(18:3n3/20:3n6/22:6n3)
Triacylglycerol(60:12)
Triglyceride

hmdb:HMDB55279 		secondary/obsolete/fantasy identifier