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PC(18:3(6Z,9Z,12Z)/18:0)

PropertiesImage
MNX_IDMNXM69760 Image of MNXM69760
referencechebi:89548
formulaC44H82NO8P
global charge0
mol weight784.113
InChIKeyHOOCTPAZCNJQPX-OJKLBMRPSA-N
InChIInChI=1S/C44H82NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h14,16,20,22,26,28,42H,6-13,15,17-19,21,23-25,27,29-41H2,1-5H3/b16-14-,22-20-,28-26-/t42-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C44H82NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h14,16,20,22,26,28,42H,6-13,15,17-19,21,23-25,27,29-41H2,1-5H3/b16-14-,22-20-,28-26-/t42-/m1/s1 Image of MNXM69760
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30][CH2:32][CH2:34][CH2:36][C:43](=[O:46])[O:50][CH2:40][C@H:42]([CH2:41][O:52][P:54](=[O:48])([O-:49])[O:51][CH2:39][CH2:38][N+:45]([CH3:3])([CH3:4])[CH3:5])[O:53][C:44]([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:47]
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:89548
chebi:89548
HOOCTPAZCNJQPX-OJKLBMRPSA-N 		PC(18:3(6Z,9Z,12Z)/18:0)
1-g-Linolenoyl-2-stearoyl-sn-glycero-3-phosphocholine
1-gamma-Linolenoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(18:3/18:0)
GPCho(18:3n6/18:0)
GPCho(18:3w6/18:0)
GPCho(36:3)
Lecithin
PC aa C36:3
PC(18:3/18:0)
PC(18:3n6/18:0)
PC(18:3w6/18:0)
PC(36:3)
Phosphatidylcholine(18:3/18:0)
Phosphatidylcholine(18:3n6/18:0)
Phosphatidylcholine(18:3w6/18:0)
Phosphatidylcholine(36:3)
trimethyl(2-{[(2R)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-2-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)azanium

SLM:000011071
slm:000011071
HOOCTPAZCNJQPX-OJKLBMRPSA-N 		1-(6Z,9Z,12Z-octadecatrienoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
PC(18:3(6Z,9Z,12Z)/18:0)
Phosphatidylcholine (18:3(6Z,9Z,12Z)/18:0)
hmdb:HMDB0008168
HOOCTPAZCNJQPX-OJKLBMRPSA-N 		PC(18:3(6Z,9Z,12Z)/18:0)
1-(6Z,9Z,12Z-Octadecatrienoyl)-2-octadecanoyl-sn-glycero-3-phosphocholine
1-g-Linolenoyl-2-stearoyl-sn-glycero-3-phosphocholine
GPCho(18:3/18:0)
GPCho(36:3)
Lecithin
PC(18:3/18:0)
PC(36:3)
Phosphatidylcholine(18:3/18:0)
Phosphatidylcholine(36:3)
lecithin
trimethyl(2-{[(2R)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-2-(octadecanoyloxy)propyl phosphonato]oxy}ethyl)azanium

lipidmaps:LMGP01011651
lipidmapsM:LMGP01011651
HOOCTPAZCNJQPX-OJKLBMRPSA-N 		PC(18:3(6Z,9Z,12Z)/18:0)
1-(6Z,9Z,12Z-octadecatrienoyl)-2-octadecanoyl-glycero-3-phosphocholine
PC 36:3
PC(18:0_18:3)
PC(36:3)

hmdb:HMDB08168 		secondary/obsolete/fantasy identifier