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1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM137941 Image of MNXM137941
referenceslm:000224619
formulaC63H102O6
global charge0
mol weight955.503
InChIKeyKAOUTJZLIDQIDJ-SVIMKBJRSA-N
InChIInChI=1S/C63H102O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h8-9,11-12,16-21,25-29,34-35,38,44,47,60H,4-7,10,13-15,22-24,30-33,36-37,39-43,45-46,48-59H2,1-3H3/b11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-27-,38-35-,47-44-/t60-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C63H102O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h8-9,11-12,16-21,25-29,34-35,38,44,47,60H,4-7,10,13-15,22-24,30-33,36-37,39-43,45-46,48-59H2,1-3H3/b11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-27-,38-35-,47-44-/t60-/m0/s1 Image of MNXM137941
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][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])[CH2:59][O:68][C:62]([CH2:56][CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:41]/[CH:38]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:65]
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:000224619
slm:000224619
KAOUTJZLIDQIDJ-SVIMKBJRSA-N
1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol
TG(20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)/18:3(9Z,12Z,15Z))
Triacylglycerol (20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)/18:3(9Z,12Z,15Z))
hmdb:HMDB0055291
KAOUTJZLIDQIDJ-SVIMKBJRSA-N
TG(18:3(9Z,12Z,15Z)/22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z))
(2S)-1-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propan-2-yl (13Z,16Z)-docosa-13,16-dienoate
1-(9Z,12Z,15Z-Octadeatrienoyl)-2-(13Z,16Z-docosadienoyl)-3-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-glycerol
1-a-Linolenoyl-2-docosadienoyl-3-eicosapentaenoyl-glycerol
TAG(18:3/22:2/20:5)
TAG(60:10)
TG(18:3/22:2/20:5)
TG(60:10)
Tracylglycerol(18:3/22:2/20:5)
Tracylglycerol(60:10)
Triacylglycerol
Triglyceride

hmdb:HMDB55291
secondary/obsolete/fantasy identifier