Metabolite O-desmethyl-galantamine
- Name
- O-desmethyl-galantamine
- Description
- Not Available
- Structure
- Synonyms
- Not Available
- UNII
- L7ZOW3CZ7W
- CAS number
- Not Available
- Weight
- Average: 273.332
Monoisotopic: 273.136493476 - Chemical Formula
- C16H19NO3
- InChI Key
- OYSGWKOGUVOGFQ-RBOXIYTFSA-N
- InChI
- InChI=1S/C16H19NO3/c1-17-7-6-16-5-4-11(18)8-13(16)20-15-12(19)3-2-10(9-17)14(15)16/h2-5,11,13,18-19H,6-9H2,1H3/t11-,13-,16-/m0/s1
- IUPAC Name
- (1S,12S,14R)-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6(17),7,9,15-tetraene-9,14-diol
- SMILES
- [H][C@]12C[C@@H](O)C=C[C@]11CCN(C)CC3=C1C(O2)=C(O)C=C3
- Reactions
- Galantamine O-desmethyl-galantamine
- O-desmethyl-galantamine O-desmethyl-galantamine glucuronide
- O-desmethyl-galantamine Sulfate conjugate of O-desmethyl-galantamine
- Galantamine O-desmethyl-galantamine
- Spectra
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 169.8803829 predictedDarkChem Lite v0.1.0 [M-H]- 169.9188829 predictedDarkChem Lite v0.1.0 [M-H]- 165.24934 predictedDeepCCS 1.0 (2019) [M+H]+ 170.0653829 predictedDarkChem Lite v0.1.0 [M+H]+ 170.0114829 predictedDarkChem Lite v0.1.0 [M+H]+ 167.60738 predictedDeepCCS 1.0 (2019) [M+Na]+ 169.4843829 predictedDarkChem Lite v0.1.0 [M+Na]+ 169.4788829 predictedDarkChem Lite v0.1.0 [M+Na]+ 174.40463 predictedDeepCCS 1.0 (2019) - External Links
- Not Available
- Predicted Properties
Property Value Source logP 0.78 Chemaxon pKa (Strongest Acidic) 9.87 Chemaxon pKa (Strongest Basic) 8.51 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 52.93 Å2 Chemaxon Rotatable Bond Count 0 Chemaxon Refractivity 77.82 m3·mol-1 Chemaxon Polarizability 29.46 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon