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1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM939219

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

formula

C₈₇H₁₄₃NO₉P

charge

-1

mass

1377.0506

reference

slm:000631604

InChIKey

YGPWWBRPXYIHBC-MEJPWHFASA-M

InChI

InChI=1S/C87H144NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-39-40-41-42-43-44-45-47-48-50-52-54-57-60-63-66-69-72-75-78-86(90)94-82-84(83-96-98(92,93)95-81-80-88-85(89)77-74-71-68-65-62-59-56-27-24-21-18-15-12-9-6-3)97-87(91)79-76-73-70-67-64-61-58-55-53-51-49-46-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-29,32-35,38-39,46,49,53,55-56,62,65,84H,4-6,9,12-15,22-24,30-31,36-37,40-45,47-48,50-52,54,57-61,63-64,66-83H2,1-3H3,(H,88,89)(H,92,93)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,39-38-,49-46-,55-53-,56-27-,65-62-/t84-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=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)CCCC/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:000631604 slm:000631604	1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine N-(6Z,9Z,12Z-octadecatrienoyl)-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/28:6(10Z,13Z,16Z,19Z,22Z,25Z)/18:3(6Z,9Z,12Z))