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1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM939273

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

formula

C₉₉H₁₆₁NO₉P

charge

-1

mass

1539.19145

reference

slm:000631658

InChIKey

SBVFMTOFVWPUDR-BSXXPOSTSA-M

InChI

InChI=1S/C99H162NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-40-42-44-46-48-50-52-54-56-58-60-63-66-69-72-75-78-81-84-87-90-98(102)106-94-96(95-108-110(104,105)107-93-92-100-97(101)89-86-83-80-77-74-71-68-65-62-33-30-27-24-21-18-15-12-9-6-3)109-99(103)91-88-85-82-79-76-73-70-67-64-61-59-57-55-53-51-49-47-45-43-41-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,34-37,40-43,47,49,62,65,71,74,80,83,96H,4-6,13-15,22-24,31-33,38-39,44-46,48,50-61,63-64,66-70,72-73,75-79,81-82,84-95H2,1-3H3,(H,100,101)(H,104,105)/p-1/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-34-,37-35-,42-40-,43-41-,49-47-,65-62-,74-71-,83-80-/t96-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=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:000631658 slm:000631658	1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-sn-glycero-3-phospho-N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-ethanolamine N-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/36:6(18Z,21Z,24Z,27Z,30Z,33Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))