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1-[(7Z,10Z,13Z,16Z)-docosatetraenoyl]-2-octadecanoyl-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM70504 Image of MNXM70504
referencechebi:86200
formulaC48H88NO8P
global charge0
mol weight838.205
InChIKeyYVFBVKJWPMCQQG-NRICRUJBSA-N
InChIInChI=1S/C48H88NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-2/h14,16,20,22,24-25,28,30,46H,6-13,15,17-19,21,23,26-27,29,31-45H2,1-5H3/b16-14-,22-20-,25-24-,30-28-/t46-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C48H88NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-2/h14,16,20,22,24-25,28,30,46H,6-13,15,17-19,21,23,26-27,29,31-45H2,1-5H3/b16-14-,22-20-,25-24-,30-28-/t46-/m1/s1 Image of MNXM70504
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:27]/[CH:28]=[CH:30]\[CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:47](=[O:50])[O:54][CH2:44][C@H:46]([CH2:45][O:56][P:58](=[O:52])([O-:53])[O:55][CH2:43][CH2:42][N+:49]([CH3:3])([CH3:4])[CH3:5])[O:57][C:48]([CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:26][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:51]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:86200
chebi:86200
YVFBVKJWPMCQQG-NRICRUJBSA-N 		1-[(7Z,10Z,13Z,16Z)-docosatetraenoyl]-2-octadecanoyl-sn-glycero-3-phosphocholine
(2R)-3-{[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy}-2-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
1-Adrenoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(22:4n6/18:0)
GPCho(22:4w6/18:0)
PC(22:4(7Z,10Z,13Z,16Z)/18:0)
PC(22:4n6/18:0)
PC(22:4w6/18:0)
Phosphatidylcholine(22:4n6/18:0)
Phosphatidylcholine(22:4w6/18:0)

SLM:000011387
slm:000011387
YVFBVKJWPMCQQG-NRICRUJBSA-N 		1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
PC(22:4(7Z,10Z,13Z,16Z)/18:0)
Phosphatidylcholine (22:4(7Z,10Z,13Z,16Z)/18:0)
hmdb:HMDB0008628
YVFBVKJWPMCQQG-NRICRUJBSA-N 		PC(22:4(7Z,10Z,13Z,16Z)/18:0)
(2-{[(2R)-3-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyloxy]-2-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-(7Z,10Z,13Z,16Z-Docosatetraenoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
1-Adrenoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(22:4/18:0)
GPCho(22:4W6/18:0)
GPCho(22:4n6/18:0)
GPCho(40:4)
Lecithin
PC(22:4/18:0)
PC(22:4W6/18:0)
PC(22:4n6/18:0)
PC(40:4)
Phosphatidylcholine(22:4/18:0)
Phosphatidylcholine(22:4W6/18:0)
Phosphatidylcholine(22:4n6/18:0)
Phosphatidylcholine(40:4)
lecithin

lipidmaps:LMGP01012077
lipidmapsM:LMGP01012077
YVFBVKJWPMCQQG-NRICRUJBSA-N 		PC(22:4(7Z,10Z,13Z,16Z)/18:0)
1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-octadecanoyl-glycero-3-phosphocholine
PC 40:4
PC(18:0_22:4)
PC(40:4)

hmdb:HMDB08628 		secondary/obsolete/fantasy identifier