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PC(o-18:1(9Z)/18:1(11Z))

PropertiesImage
MNX_IDMNXM70904 Image of MNXM70904
referencechebi:89883
formulaC44H86NO7P
global charge0
mol weight772.146
InChIKeyGSROTDACALJGFK-YIFANWOHSA-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/h17,19-20,22,43H,6-16,18,21,23-42H2,1-5H3/b19-17-,22-20-/t43-/m1/s1
SMILESCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COCCCCCCCC/C=C\CCCCCCCC)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/h17,19-20,22,43H,6-16,18,21,23-42H2,1-5H3/b19-17-,22-20-/t43-/m1/s1 Image of MNXM70904
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18]/[CH:20]=[CH:22]\[CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:39][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][CH2:23][CH2:21]/[CH:19]=[CH: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:89883
chebi:89883
GSROTDACALJGFK-YIFANWOHSA-N 		PC(o-18:1(9Z)/18:1(11Z))
1-Oleyl-2-vaccenoyl-sn-glycero-3-phosphocholine
GPCho(18:1/18:1)
GPCho(18:1n9/18:1n7)
GPCho(18:1w9/18:1w7)
GPCho(36:2)
Lecithin
PC ae C36:2
PC(18:1/18:1)
PC(18:1n9/18:1n7)
PC(18:1w9/18:1w7)
PC(36:2)
PC(O-36:2)
Phosphatidylcholine(18:1/18:1)
Phosphatidylcholine(18:1n9/18:1n7)
Phosphatidylcholine(18:1w9/18:1w7)
Phosphatidylcholine(36:2)
trimethyl(2-{[(2R)-2-[(11Z)-octadec-11-enoyloxy]-3-[(9Z)-octadec-9-en-1-yloxy]propyl phosphonato]oxy}ethyl)azanium

SLM:000027796
slm:000027796
GSROTDACALJGFK-YIFANWOHSA-N 		1-O-(9Z-octadecenyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine
1-(9Z-octadecenyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC(O-18:1(9Z)/18:1(11Z))
Phosphatidylcholine (O-18:1(9Z)/18:1(11Z))
hmdb:HMDB0013428
GSROTDACALJGFK-YIFANWOHSA-N 		PC(O-18:1(9Z)/18:1(11Z))
1-(9Z-Octadecenyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine
1-Oleyl-2-vaccenoyl-sn-glycero-3-phosphocholine
Gpcho(18:1/18:1)
Gpcho(18:1W9/18:1W7)
Gpcho(18:1n9/18:1n7)
Gpcho(36:2)
Lecithin
PC Ae C36:2
PC(18:1/18:1)
PC(18:1W9/18:1W7)
PC(18:1n9/18:1n7)
PC(36:2)
PC(O-36:2)
PC(o-18:1(9Z)/18:1(11Z))
Phosphatidylcholine(18:1/18:1)
Phosphatidylcholine(18:1W9/18:1W7)
Phosphatidylcholine(18:1n9/18:1n7)
Phosphatidylcholine(36:2)
trimethyl(2-{[(2R)-2-[(11Z)-octadec-11-enoyloxy]-3-[(9Z)-octadec-9-en-1-yloxy]propyl phosphonato]oxy}ethyl)azanium

lipidmaps:LMGP01020263
lipidmapsM:LMGP01020263
GSROTDACALJGFK-YIFANWOHSA-N 		PC(O-18:1(9Z)/18:1(11Z))
1-(9Z-octadecenyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine
PC O-36:2
PC(O-18:1/18:1)
PC(O-36:2)

hmdb:HMDB13428 		secondary/obsolete/fantasy identifier