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1-(6Z,9Z,12Z-octadecatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-eicosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM138820 Image of MNXM138820
referenceslm:000229048
formulaC63H106O6
global charge0
mol weight959.535
InChIKeyBPDREBISDHEJBG-XPOREUEJSA-N
InChIInChI=1S/C63H106O6/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/h7,10,16,18-19,21,25,27-28,31,33-34,39-40,42-43,60H,4-6,8-9,11-15,17,20,22-24,26,29-30,32,35-38,41,44-59H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,33-31-,34-27-,42-39-,43-40-/t60-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C63H106O6/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/h7,10,16,18-19,21,25,27-28,31,33-34,39-40,42-43,60H,4-6,8-9,11-15,17,20,22-24,26,29-30,32,35-38,41,44-59H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,33-31-,34-27-,42-39-,43-40-/t60-/m1/s1 Image of MNXM138820
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]\[CH2:36]/[CH:39]=[CH: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]/[CH:43]=[CH:40]\[CH2:37]/[CH:34]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[CH2:59][O:68][C:62]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][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:000229048
slm:000229048
BPDREBISDHEJBG-XPOREUEJSA-N 		1-(6Z,9Z,12Z-octadecatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-eicosanoyl-sn-glycerol
TG(18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:0)
Triacylglycerol (18:3(6Z,9Z,12Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:0)
hmdb:HMDB0046191
BPDREBISDHEJBG-XPOREUEJSA-N 		TG(20:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:3(6Z,9Z,12Z))
(2S)-1-(icosanoyloxy)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propan-2-yl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
1-Arachidonyl-2-docosapentaenoyl-3-g-linolenoyl-glycerol
1-Eicosanoyl-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-(6Z,9Z,12Z-octadecatrienoyl)-glycerol
TAG(20:0/22:5/18:3)
TAG(60:8)
TG(20:0/22:5/18:3)
TG(60:8)
Tracylglycerol(20:0/22:5/18:3)
Tracylglycerol(60:8)
Triacylglycerol
Triglyceride

hmdb:HMDB46191 		secondary/obsolete/fantasy identifier