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1-(9Z,12Z-hexadecadienoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phosphoethanolamine

Properties

Image

Occurences in reactions

MNX_ID

MNXM322277

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

formula

C₅₁H₈₆NO₈P

charge

mass

871.60911

reference

slm:000034457

InChIKey

CTZSNKXWFVNXTA-DRKJLUIBSA-N

InChI

InChI=1S/C51H86NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-16-14-12-10-8-6-4-2/h5,7-8,10-11,13-14,16-18,20-21,23-24,26-27,49H,3-4,6,9,12,15,19,22,25,28-48,52H2,1-2H3,(H,55,56)/b7-5-,10-8-,13-11-,16-14-,18-17-,21-20-,24-23-,27-26-/t49-/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)CCCCCCC/C=C\C/C=C\CCC)COP(=O)([O-])OCC[NH3+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
SLM:000034457 slm:000034457	1-(9Z,12Z-hexadecadienoyl)-2-(12Z,15Z,18Z,21Z,24Z,27Z-triacontahexaenoyl)-sn-glycero-3-phosphoethanolamine PE(16:2(9Z,12Z)/30:6(12Z,15Z,18Z,21Z,24Z,27Z)) Phosphatidylethanolamine (16:2(9Z,12Z)/30:6(12Z,15Z,18Z,21Z,24Z,27Z))