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

Properties

Image

Occurences in reactions

MNX_ID

MNXM939175

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

formula

C₈₅H₁₃₃NO₉P

charge

-1

mass

1342.97235

reference

slm:000631560

InChIKey

BCHITVSPPZHTIO-GVHLFSRZSA-M

InChI

InChI=1S/C85H134NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-38-39-40-41-42-43-44-45-46-47-50-52-55-58-61-64-67-70-73-76-84(88)92-80-82(95-85(89)77-74-71-68-65-62-59-56-53-49-33-30-27-24-21-18-15-12-9-6-3)81-94-96(90,91)93-79-78-86-83(87)75-72-69-66-63-60-57-54-51-48-32-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-30,34-35,37-38,48-49,51,53,57,59-60,62,66,68-69,71,82H,4-6,13-15,22-24,31-33,36,39-47,50,52,54-56,58,61,63-65,67,70,72-81H2,1-3H3,(H,86,87)(H,90,91)/p-1/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-34-,38-37-,51-48-,53-49-,60-57-,62-59-,69-66-,71-68-/t82-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=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:000631560 slm:000631560	1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-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-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))