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1-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM949663

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

formula

C₈₅H₁₃₉NO₉P

charge

-1

mass

1349.0193

reference

slm:000642048

InChIKey

UQZQKRLIXISKHV-CSVAESNCSA-M

InChI

InChI=1S/C85H140NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-37-38-39-40-41-42-43-44-45-47-48-50-52-55-58-61-64-67-70-73-76-84(88)92-80-82(81-94-96(90,91)93-79-78-86-83(87)75-72-69-66-63-60-57-54-27-24-21-18-15-12-9-6-3)95-85(89)77-74-71-68-65-62-59-56-53-51-49-46-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-29,32-35,37-38,40-41,49,51,54,60,63,82H,4-6,9,12-15,22-24,30-31,36,39,42-48,50,52-53,55-59,61-62,64-81H2,1-3H3,(H,86,87)(H,90,91)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,38-37-,41-40-,51-49-,54-27-,63-60-/t82-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC/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:000642048 slm:000642048	1-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine N-(6Z,9Z,12Z-octadecatrienoyl)-1-(18Z,21Z,24Z,27Z,30Z,33Z-hexatriacontahexaenoyl)-2-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:6(18Z,21Z,24Z,27Z,30Z,33Z)/26:5(11Z,14Z,17Z,20Z,23Z)/18:3(6Z,9Z,12Z))