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1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycerol

Properties

Image

Occurences in reactions

MNX_ID

MNXM138128

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₆₅H₁₀₂O₆

charge

mass

979.50178

reference

slm:000241721

InChIKey

TXXAAMLWYFWSKB-LCRQXKBFSA-N

InChI

InChI=1S/C65H102O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-38-35-33-31-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-29,32,34,36,40,42-43,45,49,52,62H,4-6,8,11,13-15,22-24,30-31,33,35,37-39,41,44,46-48,50-51,53-61H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,36-27-,43-40-,45-42-,52-49-/t62-/m0/s1

SMILES

CCCCC\C=C/C\C=C/CCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCC\C=C/C\C=C/C\C=C/C\C=C/CC)COC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000241721 slm:000241721	1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(13Z,16Z-docosadienoyl)-3-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycerol TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z)) Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)/18:4(6Z,9Z,12Z,15Z))
hmdb:HMDB0055481	TG(18:4(6Z,9Z,12Z,15Z)/22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (2S)-2-[(13Z,16Z)-docosa-13,16-dienoyloxy]-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate 1-(6Z,9Z,12Z,15Z-Octadecatetraenoyl)-2-(13Z,16Z-docosadienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol 1-Stearidonoyl-2-docosadienoyl-3-docosahexaenoyl-glycerol TAG(18:4/22:2/22:6) TAG(62:12) TG(18:4/22:2/22:6) TG(62:12) Tracylglycerol(18:4/22:2/22:6) Tracylglycerol(62:12) Triacylglycerol Triglyceride
hmdb:HMDB55481	secondary/obsolete/fantasy identifier