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1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM939328

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

formula

C₈₁H₁₃₉NO₉P

charge

-1

mass

1301.0193

reference

slm:000631713

InChIKey

JFDHEAGXDMKCLU-KPEQIERKSA-M

InChI

InChI=1S/C81H140NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-40-41-42-43-44-45-47-48-51-54-57-60-63-66-69-72-80(84)88-76-78(91-81(85)73-70-67-64-61-58-55-52-49-46-31-29-26-23-20-17-14-11-8-5-2)77-90-92(86,87)89-75-74-82-79(83)71-68-65-62-59-56-53-50-27-24-21-18-15-12-9-6-3/h7,9-10,12,16-21,25-29,32-33,35-36,50,78H,4-6,8,11,13-15,22-24,30-31,34,37-49,51-77H2,1-3H3,(H,82,83)(H,86,87)/p-1/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-32-,36-35-,50-27-/t78-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=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:000631713 slm:000631713	1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine N-(9Z,12Z,15Z-octadecatrienoyl)-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/22:2(13Z,16Z)/18:3(9Z,12Z,15Z))