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PC(O-20:0/19:0)

PropertiesImage
MNX_IDMNXM70943 Image of MNXM70943
referencechebi:169642
formulaC47H96NO7P
global charge0
mol weight818.259
InChIKeyIXTPFVGINJHUNS-YACUFSJGSA-N
InChIInChI=1S/C47H96NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-42-52-44-46(45-54-56(50,51)53-43-41-48(3,4)5)55-47(49)40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h46H,6-45H2,1-5H3/t46-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C47H96NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-42-52-44-46(45-54-56(50,51)53-43-41-48(3,4)5)55-47(49)40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h46H,6-45H2,1-5H3/t46-/m1/s1 Image of MNXM70943
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:24][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:42][O:52][CH2:44][C@H:46]([CH2:45][O:54][P:56](=[O:50])([O-:51])[O:53][CH2:43][CH2:41][N+:48]([CH3:3])([CH3:4])[CH3:5])[O:55][C:47]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:23][CH2:21][CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:49]
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:169642
chebi:169642
IXTPFVGINJHUNS-YACUFSJGSA-N 		PC(O-20:0/19:0)
[(2R)-3-icosoxy-2-nonadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

SLM:000028016
slm:000028016
IXTPFVGINJHUNS-YACUFSJGSA-N 		1-O-eicosyl-2-nonadecanoyl-sn-glycero-3-phosphocholine
1-eicosyl-2-nonadecanoyl-sn-glycero-3-phosphocholine
PC(O-20:0/19:0)
Phosphatidylcholine (O-20:0/19:0)

lipidmaps:LMGP01020232
lipidmapsM:LMGP01020232
IXTPFVGINJHUNS-YACUFSJGSA-N 		PC(O-20:0/19:0)
1-eicosyl-2-nonadecanoyl-glycero-3-phosphocholine
PC O-39:0
PC(O-20:0/19:0)
PC(O-39:0)