1-(8Z,11Z,14Z-eicosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine

Properties

Image

Occurences in reactions

MNX_ID

MNXM70169

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

formula

C₅₀H₈₄NO₈P

charge

mass

858.177661

reference

slm:000011676

InChIKey

XRKOURBHCPRURX-OSDDFXMNSA-N

InChI

InChI=1S/C50H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,25,27-28,30-31,33,48H,6-7,9,11-13,18-19,24,26,29,32,34-47H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,27-25-,30-28-,33-31-/t48-/m1/s1

SMILES

CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCC\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:000011676 slm:000011676	1-(8Z,11Z,14Z-eicosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine PC(20:3(8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) Phosphatidylcholine (20:3(8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z))
hmdb:HMDB0008418	PC(20:3(8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)) (2-{[(2R)-2-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]propyl phosphono]oxy}ethyl)trimethylazanium 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine 1-homo-g-linolenoyl-2-docosapentaenoyl-sn-glycero-3-phosphocholine GPCho(20:3/22:5) GPCho(42:8) Lecithin PC(20:3/22:5) PC(42:8) Phosphatidylcholine(20:3/22:5) Phosphatidylcholine(42:8)
hmdb:HMDB08418	secondary/obsolete/fantasy identifier