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

PropertiesImage
MNX_IDMNXM70113 Image of MNXM70113
referencechebi:89108
formulaC48H90NO8P
global charge0
mol weight840.221
InChIKeyZZJQEMSWMGGWDG-OCRPJUMPSA-N
InChIInChI=1S/C48H90NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20,22,26,28,32,34,46H,6-19,21,23-25,27,29-31,33,35-45H2,1-5H3/b22-20-,28-26-,34-32-/t46-/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)CCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C48H90NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20,22,26,28,32,34,46H,6-19,21,23-25,27,29-31,33,35-45H2,1-5H3/b22-20-,28-26-,34-32-/t46-/m1/s1 Image of MNXM70113
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH: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][CH2:27][CH2:25][CH2:23][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:89108
chebi:89108
ZZJQEMSWMGGWDG-OCRPJUMPSA-N 		PC(20:3(5Z,8Z,11Z)/20:0)
(2-{[(2R)-3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(icosanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-Meadoyl-2-arachidonyl-sn-glycero-3-phosphocholine
GPCho(20:3/20:0)
GPCho(20:3n9/20:0)
GPCho(20:3w9/20:0)
GPCho(40:3)
Lecithin
PC aa C40:3
PC(20:3/20:0)
PC(20:3n9/20:0)
PC(20:3w9/20:0)
PC(40:3)
Phosphatidylcholine(20:3/20:0)
Phosphatidylcholine(20:3n9/20:0)
Phosphatidylcholine(20:3w9/20:0)
Phosphatidylcholine(40:3)
hmdb:HMDB0008373
ZZJQEMSWMGGWDG-OCRPJUMPSA-N 		PC(20:3(5Z,8Z,11Z)/20:0)
(2-{[(2R)-3-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyloxy]-2-(icosanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
1-(5Z,8Z,11Z-Eicosatrienoyl)-2-eicosanoyl-sn-glycero-3-phosphocholine
1-Meadoyl-2-arachidonyl-sn-glycero-3-phosphocholine
GPCho(20:3/20:0)
GPCho(40:3)
Lecithin
PC(20:3/20:0)
PC(40:3)
Phosphatidylcholine(20:3/20:0)
Phosphatidylcholine(40:3)
lecithin

lipidmaps:LMGP01012202
lipidmapsM:LMGP01012202
ZZJQEMSWMGGWDG-OCRPJUMPSA-N 		PC(20:3(5Z,8Z,11Z)/20:0)
1-(5Z,8Z,11Z-eicosatrienoyl)-2-eicosanoyl-sn-glycero-3-phosphocholine
PC 40:3
PC(20:0_20:3)
PC(40:3)

hmdb:HMDB08373 		secondary/obsolete/fantasy identifier