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1-(10Z,13Z,16Z-docosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM957868

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

formula

C₆₉H₁₁₁NO₉P

charge

-1

mass

1128.80019

reference

slm:000650253

InChIKey

BOPLTEVGQXLNAU-SOGALYDPSA-M

InChI

InChI=1S/C69H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-68(72)76-64-66(79-69(73)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3/h8,11,16-21,25-30,33-34,36-38,41,43,46-47,50,66H,4-7,9-10,12-15,22-24,31-32,35,39-40,42,44-45,48-49,51-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-33-,37-34-,41-38-,46-43-,50-47-/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)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000650253 slm:000650253	1-(10Z,13Z,16Z-docosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phospho-N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-ethanolamine N-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-1-(10Z,13Z,16Z-docosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (22:3(10Z,13Z,16Z)/22:5(7Z,10Z,13Z,16Z,19Z)/20:4(5Z,8Z,11Z,14Z))