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1-(8Z,11Z,14Z-eicosatrienoyl)-2-(6Z,9Z,12Z,15Z,18Z-tetracosapentaenoyl)-sn-glycero-3-phospho-N-(9Z,12Z-octadecadienoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM957180

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

formula

C₆₇H₁₁₁NO₉P

charge

-1

mass

1104.80019

reference

slm:000649565

InChIKey

XMBUZPJBUIIQSS-WKDJQCIHSA-M

InChI

InChI=1S/C67H112NO9P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-35-38-41-44-47-50-53-56-59-67(71)77-64(62-74-66(70)58-55-52-49-46-43-40-37-34-29-26-23-20-17-14-11-8-5-2)63-76-78(72,73)75-61-60-68-65(69)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3/h16-21,25-29,31-32,35-38,40,44,47,64H,4-15,22-24,30,33-34,39,41-43,45-46,48-63H2,1-3H3,(H,68,69)(H,72,73)/p-1/b19-16-,20-17-,21-18-,28-25-,29-26-,32-31-,36-27-,38-35-,40-37-,47-44-/t64-/m1/s1

SMILES

CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\CCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000649565 slm:000649565	1-(8Z,11Z,14Z-eicosatrienoyl)-2-(6Z,9Z,12Z,15Z,18Z-tetracosapentaenoyl)-sn-glycero-3-phospho-N-(9Z,12Z-octadecadienoyl)-ethanolamine N-(9Z,12Z-octadecadienoyl)-1-(8Z,11Z,14Z-eicosatrienoyl)-2-(6Z,9Z,12Z,15Z,18Z-tetracosapentaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (20:3(8Z,11Z,14Z)/24:5(6Z,9Z,12Z,15Z,18Z)/18:2(9Z,12Z))