PDB CCD ID: | LPE |
Number of entries in BioLiP: | 201 |
Chemical formula: | C26 H57 N O6 P |
InChI: | InChI=1S/C26H56NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h26,28H,5-25H2,1-4H3/p+1/t26-/m1/s1 |
InChIKey: | XKBJVQHMEXMFDZ-AREMUKBSSA-O |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)O | OpenEye OEToolkits 1.5.0 | CCCCCCCCCCCCCCCCCCOC[C@H](CO[P@@](=O)(O)OCC[N+](C)(C)C)O | ACDLabs 10.04 | O=P(OCC(O)COCCCCCCCCCCCCCCCCCC)(OCC[N+](C)(C)C)O | CACTVS 3.341 | CCCCCCCCCCCCCCCCCCOC[C@@H](O)CO[P@](O)(=O)OCC[N+](C)(C)C | CACTVS 3.341 | CCCCCCCCCCCCCCCCCCOC[CH](O)CO[P](O)(=O)OCC[N+](C)(C)C |
|
Name: | 1-O-OCTADECYL-SN-GLYCERO-3-PHOSPHOCHOLINE; LPC-ETHER |
DrugBank: | DB03633 |
ZINC: | ZINC000008860508 |