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1-(10Z,13Z,16Z-docosatrienoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phospho-N-octanoyl-ethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM958040

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

formula

C₆₅H₁₀₉NO₉P

charge

-1

mass

1078.78454

reference

slm:000650425

InChIKey

CFWAWEIHONEUNG-WLSUPUOOSA-M

InChI

InChI=1S/C65H110NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-29-30-31-32-33-34-36-38-40-42-44-46-48-51-54-57-65(69)75-62(61-74-76(70,71)73-59-58-66-63(67)55-52-49-12-9-6-3)60-72-64(68)56-53-50-47-45-43-41-39-37-35-26-24-22-20-18-16-14-11-8-5-2/h7,10,15-18,21-24,27-28,30-31,33-35,37,62H,4-6,8-9,11-14,19-20,25-26,29,32,36,38-61H2,1-3H3,(H,66,67)(H,70,71)/p-1/b10-7-,17-15-,18-16-,23-21-,24-22-,28-27-,31-30-,34-33-,37-35-/t62-/m1/s1

SMILES

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000650425 slm:000650425	1-(10Z,13Z,16Z-docosatrienoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phospho-N-octanoyl-ethanolamine N-octanoyl-1-(10Z,13Z,16Z-docosatrienoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phosphoethanolamine NAPE (22:3(10Z,13Z,16Z)/30:6(12Z,15Z,18Z,21Z,24Z,27Z)/8:0)