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

Properties

Image

Occurences in reactions

MNX_ID

MNXM137566

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

formula

C₆₃H₁₀₄O₆

charge

mass

957.49626

reference

slm:000226915

InChIKey

BTYYWBNWBIXRST-VZPOCRQRSA-N

InChI

InChI=1S/C63H104O6/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/h7,10,16,18-19,21,25,27-28,31,33-34,38,40-41,43,47,50,60H,4-6,8-9,11-15,17,20,22-24,26,29-30,32,35-37,39,42,44-46,48-49,51-59H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,33-31-,34-27-,41-38-,43-40-,50-47-/t60-/m0/s1

SMILES

CCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCC\C=C/C\C=C/C\C=C/CCCCC)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:000226915 slm:000226915	1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-eicosanoyl-3-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycerol TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:0/18:3(6Z,9Z,12Z)) Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:0/18:3(6Z,9Z,12Z))
hmdb:HMDB0052913	TG(18:3(6Z,9Z,12Z)/20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (2S)-2-(icosanoyloxy)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate 1-(6Z,9Z,12Z-Octadecatrienoyl)-2-eicosanoyl-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol 1-g-Linolenoyl-2-arachidonyl-3-docosahexaenoyl-glycerol TAG(18:3/20:0/22:6) TAG(60:9) TG(18:3/20:0/22:6) TG(60:9) Tracylglycerol(18:3/20:0/22:6) Tracylglycerol(60:9) Triacylglycerol Triglyceride
hmdb:HMDB52913	secondary/obsolete/fantasy identifier