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1-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-(13Z,16Z-docosadienoyl)-sn-glycerol

Properties

Image

Occurences in reactions

MNX_ID

MNXM142877

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

formula

C₆₉H₁₁₀O₆

charge

mass

1034.83024

reference

slm:000274553

InChIKey

PXWCVQKIBJNOFX-VWXKZWKSSA-N

InChI

InChI=1S/C69H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,16-21,25-30,34,36-37,39,43,45-46,48,52,55,66H,4-8,10-11,13-15,22-24,31-33,35,38,40-42,44,47,49-51,53-54,56-65H2,1-3H3/b12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,37-34-,39-36-,46-43-,48-45-,55-52-/t66-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000274553 slm:000274553	1-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-(13Z,16Z-docosadienoyl)-sn-glycerol TG(22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z)) Triacylglycerol (22:5(4Z,7Z,10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:2(13Z,16Z))
hmdb:HMDB0054613	TG(22:2(13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(4Z,7Z,10Z,13Z,16Z)) (2S)-1-[(13Z,16Z)-docosa-13,16-dienoyloxy]-3-[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]propan-2-yl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate 1-(13Z,16Z-Docosadienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-3-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-glycerol 1-Docosadienoyl-2-docosapentaenoyl-3-osbondoyl-glycerol TAG(22:2/22:5/22:5) TAG(66:12) TG(22:2/22:5/22:5) TG(66:12) Tracylglycerol(22:2/22:5/22:5) Tracylglycerol(66:12) Triacylglycerol Triglyceride
hmdb:HMDB54613	secondary/obsolete/fantasy identifier