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PC(20:3(5Z,8Z,11Z)/18:0)

PropertiesImage
MNX_IDMNXM70106 Image of MNXM70106
referencechebi:89111
formulaC46H86NO8P
global charge0
mol weight812.167
InChIKeyZQCXMBYHCICNPX-FIAOWNBRSA-N
InChIInChI=1S/C46H86NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-26-28-30-32-34-36-38-45(48)52-42-44(43-54-56(50,51)53-41-40-47(3,4)5)55-46(49)39-37-35-33-31-29-27-24-21-19-17-15-13-11-9-7-2/h20,22,25-26,30,32,44H,6-19,21,23-24,27-29,31,33-43H2,1-5H3/b22-20-,26-25-,32-30-/t44-/m1/s1
SMILESCCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C46H86NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-26-28-30-32-34-36-38-45(48)52-42-44(43-54-56(50,51)53-41-40-47(3,4)5)55-46(49)39-37-35-33-31-29-27-24-21-19-17-15-13-11-9-7-2/h20,22,25-26,30,32,44H,6-19,21,23-24,27-29,31,33-43H2,1-5H3/b22-20-,26-25-,32-30-/t44-/m1/s1 Image of MNXM70106
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:25]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34][CH2:36][CH2:38][C:45](=[O:48])[O:52][CH2:42][C@H:44]([CH2:43][O:54][P:56](=[O:50])([O-:51])[O:53][CH2:41][CH2:40][N+:47]([CH3:3])([CH3:4])[CH3:5])[O:55][C:46]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:24][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:49]
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:89111
chebi:89111
ZQCXMBYHCICNPX-FIAOWNBRSA-N 		PC(20:3(5Z,8Z,11Z)/18:0)
(2-{[(2R)-3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-Meadoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(20:3/18:0)
GPCho(20:3n9/18:0)
GPCho(20:3w9/18:0)
GPCho(38:3)
Lecithin
PC aa C38:3
PC(20:3/18:0)
PC(20:3n9/18:0)
PC(20:3w9/18:0)
PC(38:3)
Phosphatidylcholine(20:3/18:0)
Phosphatidylcholine(20:3n9/18:0)
Phosphatidylcholine(20:3w9/18:0)
Phosphatidylcholine(38:3)
hmdb:HMDB0008366
ZQCXMBYHCICNPX-FIAOWNBRSA-N 		PC(20:3(5Z,8Z,11Z)/18:0)
(2-{[(2R)-3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-(5Z,8Z,11Z-Eicosatrienoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
1-Meadoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(20:3/18:0)
GPCho(38:3)
Lecithin
PC(20:3/18:0)
PC(38:3)
Phosphatidylcholine(20:3/18:0)
Phosphatidylcholine(38:3)
lecithin

lipidmaps:LMGP01012196
lipidmapsM:LMGP01012196
ZQCXMBYHCICNPX-FIAOWNBRSA-N 		PC(20:3(5Z,8Z,11Z)/18:0)
1-(5Z,8Z,11Z-eicosatrienoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
PC 38:3
PC(18:0_20:3)
PC(38:3)

hmdb:HMDB08366 		secondary/obsolete/fantasy identifier