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1-[(1Z)-octadecenyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM71047 Image of MNXM71047
referencechebi:86241
formulaC44H86NO7P
global charge0
mol weight772.146
InChIKeyDSWOVBIRJNAJAF-NVJOKYTBSA-N
InChIInChI=1S/C44H86NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,36,39,43H,6-20,22,24-35,37-38,40-42H2,1-5H3/b23-21-,39-36-/t43-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C44H86NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,36,39,43H,6-20,22,24-35,37-38,40-42H2,1-5H3/b23-21-,39-36-/t43-/m1/s1 Image of MNXM71047
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34]/[CH:36]=[CH:39]\[O:49][CH2:41][C@H:43]([CH2:42][O:51][P:53](=[O:47])([O-:48])[O:50][CH2:40][CH2:38][N+:45]([CH3:3])([CH3:4])[CH3:5])[O:52][C:44]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25]/[CH:23]=[CH:21]\[CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:46]
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:86241
chebi:86241
DSWOVBIRJNAJAF-NVJOKYTBSA-N 		1-[(1Z)-octadecenyl]-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine
(2R)-2-{[(9Z)-octadec-9-enoyl]oxy}-3-{[(1Z)-octadec-1-en-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
1-(1-Enyl-stearoyl)-2-oleoyl-sn-glycero-3-phosphocholine
1-(1-enyl-stearoyl)-2-oleoyl-GPC
1-(1-enyl-stearoyl)-2-oleoyl-GPC (P-18:0/18:1)
1-[(1Z)-octadecenyl]-2-oleoyl-sn-glycero-3-phosphocholine
GPC(P-18:0/18:1)
PC(P-18:0/18:1(9Z))

SLM:000049065
slm:000049065
DSWOVBIRJNAJAF-NVJOKYTBSA-N 		1-O-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine
1-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC(P-18:0/18:1(9Z))
Phosphatidylcholine (P-18:0/18:1(9Z))

lipidmaps:LMGP01030169
lipidmapsM:LMGP01030169
DSWOVBIRJNAJAF-NVJOKYTBSA-N 		PC(P-18:0/18:1(9Z))-d9
1-(1Z-octadecenyl)-2-(9Z-octadecenoyl-15,15,16,16,17,17,18,18,18-d9)-sn-glycero-3-phosphocholine
1-(1Z-octadecenyl)-2-oleoyl(d9)-sn-glycero-3-phosphocholine
hmdb:HMDB0011243
DSWOVBIRJNAJAF-NVJOKYTBSA-N 		PC(P-18:0/18:1(9Z))
1-(1-Enyl-stearoyl)-2-oleoyl-GPC
1-(1-Enyl-stearoyl)-2-oleoyl-GPC (p-18:0/18:1)
1-(1-Enyl-stearoyl)-2-oleoyl-sn-glycero-3-phosphocholine
1-(1Z-Octadecenyl)-2-oleoyl-GPC
1-(1Z-Octadecenyl)-2-oleoyl-sn-glycero-3-phosphocholine
1-(1Z-Octadecenyl)-2-oleoyl-sn-glycero-phosphatidylcholine
1-[(1Z)-Octadecenyl]-2-oleoyl-sn-glycero-3-phosphocholine
GPC(18:1/18:1)
GPC(36:2)
GPC(O-18:1(1Z)/18:1(9Z))
GPC(O-18:1(1Z)/18:1W9)
GPC(O-18:1(1Z)/18:1n9)
GPC(p-18:0/18:1(9Z))
GPC(p-18:0/18:1)
GPC(p-18:0/18:1W9)
GPC(p-18:0/18:1n9)
GPCho(18:1/18:1)
GPCho(36:2)
GPCho(O-18:1(1Z)/18:1(9Z))
GPCho(O-18:1(1Z)/18:1W9)
GPCho(O-18:1(1Z)/18:1n9)
GPCho(p-18:0/18:1(9Z))
GPCho(p-18:0/18:1W9)
GPCho(p-18:0/18:1n9)
Gpcho(18:0/18:1)
Gpcho(18:0/18:1W9)
Gpcho(18:0/18:1n9)
Gpcho(36:1)
PC(18:1/18:1)
PC(36:2)
PC(O-18:1(1Z)/18:1(9Z))
PC(O-18:1(1Z)/18:1W9)
PC(O-18:1(1Z)/18:1n9)
PC(p-18:0/18:1W9)
PC(p-18:0/18:1n9)
Phosphatidylcholine(18:1/18:1)
Phosphatidylcholine(36:2)
Phosphatidylcholine(O-18:1(1Z)/18:1(9Z))
Phosphatidylcholine(O-18:1(1Z)/18:1W9)
Phosphatidylcholine(O-18:1(1Z)/18:1n9)
Phosphatidylcholine(p-18:0/18:1(9Z))
Phosphatidylcholine(p-18:0/18:1W9)
Phosphatidylcholine(p-18:0/18:1n9)
trimethyl(2-{[(2R)-3-[(1Z)-octadec-1-en-1-yloxy]-2-[(9Z)-octadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)azanium

lipidmaps:LMGP01030013
lipidmapsM:LMGP01030013
DSWOVBIRJNAJAF-NVJOKYTBSA-N 		PC(P-18:0/18:1(9Z))
1-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC O-36:2
PC(P-18:0/18:1)
PC(P-36:1)

hmdb:HMDB11243 		secondary/obsolete/fantasy identifier