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1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM71073 Image of MNXM71073
referencechebi:133664
formulaC48H84NO7P
global charge0
mol weight818.174
InChIKeyTXHZYNSTTCIWMJ-RXSQUPBGSA-N
InChIInChI=1S/C48H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-29-31-33-35-37-39-41-48(50)56-47(46-55-57(51,52)54-44-42-49(3,4)5)45-53-43-40-38-36-34-32-30-28-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,25-26,29,31,35,37,40,43,47H,6-7,9,11-13,15,17-19,21,23-24,27-28,30,32-34,36,38-39,41-42,44-46H2,1-5H3/b10-8-,16-14-,22-20-,26-25-,31-29-,37-35-,43-40-/t47-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C48H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-29-31-33-35-37-39-41-48(50)56-47(46-55-57(51,52)54-44-42-49(3,4)5)45-53-43-40-38-36-34-32-30-28-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,25-26,29,31,35,37,40,43,47H,6-7,9,11-13,15,17-19,21,23-24,27-28,30,32-34,36,38-39,41-42,44-46H2,1-5H3/b10-8-,16-14-,22-20-,26-25-,31-29-,37-35-,43-40-/t47-/m1/s1 Image of MNXM71073
SMILES (mnx)[CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39][CH2:41][C:48](=[O:50])[O:56][C@H:47]([CH2:45][O:53]/[CH:43]=[CH:40]\[CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])[CH2:46][O:55][P:57](=[O:51])([O-:52])[O:54][CH2:44][CH2:42][N+:49]([CH3:3])([CH3:4])[CH3:5]
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:133664
chebi:133664
TXHZYNSTTCIWMJ-RXSQUPBGSA-N 		1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
(2R)-2-{[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy}-3-{[(1Z)-octadec-1-en-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
1-(1-Enyl-palmitoyl)-2-docosahexaenoyl-sn-glycero-3-phosphocholine
1-(1-enyl-stearoyl)-2-docosahexaenoyl-GPC
1-(1-enyl-stearoyl)-2-docosahexaenoyl-GPC (P-18:0/22:6)
1-[(1Z)-octadecenyl]-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphocholine
GPC(P-18:0/22:6)
PC(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PC(P-18:0/22:6)
phosphatidylcholine(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
phosphatidylcholine(P-18:0/22:6)

SLM:000049042
slm:000049042
TXHZYNSTTCIWMJ-RXSQUPBGSA-N 		1-O-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
PC(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Phosphatidylcholine (P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
hmdb:HMDB0011262
TXHZYNSTTCIWMJ-RXSQUPBGSA-N 		PC(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
(2-{[(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyloxy]-3-[(1Z)-octadec-1-en-1-yloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
1-(1-Enyl-palmitoyl)-2-docosahexaenoyl-sn-glycero-3-phosphocholine
1-(1-Enyl-stearoyl)-2-docosahexaenoyl-GPC
1-(1-Enyl-stearoyl)-2-docosahexaenoyl-GPC (p-18:0/22:6)
1-(1-Enyl-stearoyl)-2-docosahexaenoyl-sn-glycero-3-phosphocholine
1-(1Z-Octadecenyl)-2-docosahexaenoyl-GPC
1-(1Z-Octadecenyl)-2-docosahexaenoyl-sn-glycero-3-phosphocholine
1-(1Z-Octadecenyl)-2-docosahexaenoyl-sn-glycero-phosphatidylcholine
1-[(1Z)-Octadecenyl]-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphocholine
GPC(18:1/22:6)
GPC(40:7)
GPC(O-18:1(1Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
GPC(O-18:1(1Z)/22:6W3)
GPC(O-18:1(1Z)/22:6n3)
GPC(p-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
GPC(p-18:0/22:6)
GPC(p-18:0/22:6W3)
GPC(p-18:0/22:6n3)
GPCho(18:1/22:6)
GPCho(40:7)
GPCho(O-18:1(1Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
GPCho(O-18:1(1Z)/22:6W3)
GPCho(O-18:1(1Z)/22:6n3)
GPCho(p-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
GPCho(p-18:0/22:6W3)
GPCho(p-18:0/22:6n3)
PC(18:1/22:6)
PC(40:7)
PC(O-18:1(1Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PC(O-18:1(1Z)/22:6W3)
PC(O-18:1(1Z)/22:6n3)
PC(p-18:0/22:6)
PC(p-18:0/22:6W3)
PC(p-18:0/22:6n3)
Phosphatidylcholine(18:1/22:6)
Phosphatidylcholine(40:7)
Phosphatidylcholine(O-18:1(1Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Phosphatidylcholine(O-18:1(1Z)/22:6W3)
Phosphatidylcholine(O-18:1(1Z)/22:6n3)
Phosphatidylcholine(p-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
Phosphatidylcholine(p-18:0/22:6)
Phosphatidylcholine(p-18:0/22:6W3)
Phosphatidylcholine(p-18:0/22:6n3)

lipidmaps:LMGP01030014
lipidmapsM:LMGP01030014
TXHZYNSTTCIWMJ-RXSQUPBGSA-N 		PC(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
PC O-40:7
PC(P-18:0/22:6)
PC(P-40:6)

hmdb:HMDB11262 		secondary/obsolete/fantasy identifier