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1-(13Z,16Z-docosadienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(6Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM219277 Image of MNXM219277
referenceslm:000228387
formulaC63H106O6
global charge0
mol weight959.535
InChIKeyBESKRYBOGAWNKA-MCUIYYCCSA-N
InChIInChI=1S/C63H106O6/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/h8,11,16-17,19-20,25-26,28-29,36,39-40,43,45,48,60H,4-7,9-10,12-15,18,21-24,27,30-35,37-38,41-42,44,46-47,49-59H2,1-3H3/b11-8-,19-16-,20-17-,28-25-,29-26-,39-36-,43-40-,48-45-/t60-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@@H](COC(=O)CCCC/C=C\CCCCCCCCCCC)COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C63H106O6/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/h8,11,16-17,19-20,25-26,28-29,36,39-40,43,45,48,60H,4-7,9-10,12-15,18,21-24,27,30-35,37-38,41-42,44,46-47,49-59H2,1-3H3/b11-8-,19-16-,20-17-,28-25-,29-26-,39-36-,43-40-,48-45-/t60-/m0/s1 Image of MNXM219277
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][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][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]/[CH:43]=[CH:40]\[CH2:37][CH2:34][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:36]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH: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:000228387
slm:000228387
BESKRYBOGAWNKA-MCUIYYCCSA-N
1-(13Z,16Z-docosadienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(6Z-octadecenoyl)-sn-glycerol
TG(22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(6Z))
Triacylglycerol (22:2(13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)/18:1(6Z))