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

Properties

Image

Occurences in reactions

MNX_ID

MNXM137552

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

formula

C₆₁H₉₂O₆

charge

mass

921.37958

reference

slm:000198961

InChIKey

NRDALNFKZCGIPZ-KPEDKWLHSA-N

InChI

InChI=1S/C61H92O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-34-36-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-37-33-27-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-28,30-33,36,38-41,43,45,48,58H,4-6,8,11,13-15,22-24,29,34-35,37,42,44,46-47,49-57H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,31-30-,32-26-,33-27-,39-36-,41-38-,43-40-,48-45-/t58-/m0/s1

SMILES

CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)OC[C@@H](COC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)OC(=O)CCCC\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:000198961 slm:000198961	1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-2-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-3-(6Z,9Z,12Z-octadecatrienoyl)-sn-glycerol TG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)) Triacylglycerol (22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z))
hmdb:HMDB0053193	TG(18:3(6Z,9Z,12Z)/18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (2S)-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyloxy]-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-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycerol 1-g-Linolenoyl-2-stearidonoyl-3-docosahexaenoyl-glycerol TAG(18:3/18:4/22:6) TAG(58:13) TG(18:3/18:4/22:6) TG(58:13) Tracylglycerol(18:3/18:4/22:6) Tracylglycerol(58:13) Triacylglycerol Triglyceride
hmdb:HMDB53193	secondary/obsolete/fantasy identifier