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1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM939261

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

formula

C₉₃H₁₅₅NO₉P

charge

-1

mass

1461.1445

reference

slm:000631646

InChIKey

BULXOFXCMHTVNO-CBUPMTGESA-M

InChI

InChI=1S/C93H156NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-45-47-48-50-52-54-56-58-60-63-66-69-72-75-78-81-84-92(96)100-88-90(89-102-104(98,99)101-87-86-94-91(95)83-80-77-74-71-68-65-62-27-24-21-18-15-12-9-6-3)103-93(97)85-82-79-76-73-70-67-64-61-59-57-55-53-51-49-46-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-29,32-35,38-41,46,49,62,68,71,90H,4-6,9,12-15,22-24,30-31,36-37,42-45,47-48,50-61,63-67,69-70,72-89H2,1-3H3,(H,94,95)(H,98,99)/p-1/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,40-38-,41-39-,49-46-,62-27-,71-68-/t90-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=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:000631646 slm:000631646	1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoyl)-sn-glycero-3-phospho-N-(6Z,9Z,12Z-octadecatrienoyl)-ethanolamine N-(6Z,9Z,12Z-octadecatrienoyl)-1-(21Z,24Z,27Z,30Z,33Z-hexatriacontapentaenoyl)-2-(16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (36:5(21Z,24Z,27Z,30Z,33Z)/34:6(16Z,19Z,22Z,25Z,28Z,31Z)/18:3(6Z,9Z,12Z))