Framycetin sulfateProduct ingredient for Framycetin
- Name
- Framycetin sulfate
- Drug Entry
- Framycetin
A component of neomycin that is produced by Streptomyces fradiae. On hydrolysis it yields neamine and neobiosamine B. (From Merck Index, 11th ed)
- Accession Number
- DBSALT000995
- Structure
Structure for Framycetin sulfate (DBSALT000995)
- Synonyms
- Framycetin sulphate / Neomycin B trisulfate
- UNII
- Y3720KZ4TQ
- CAS Number
- 4146-30-9
- Weight
- Average: 908.87
Monoisotopic: 908.21442472 - Chemical Formula
- C23H52N6O25S3
- InChI Key
- KWBUARAINLGYMG-JGMIRXPNSA-N
- InChI
- InChI=1S/C23H46N6O13.3H2O4S/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22;3*1-5(2,3)4/h5-23,30-36H,1-4,24-29H2;3*(H2,1,2,3,4)/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+;;;/m1.../s1
- IUPAC Name
- (2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3S,4R,5S)-5-{[(1R,2R,3S,5R,6S)-3,5-diamino-2-{[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-6-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}oxane-3,4-diol; tris(sulfuric acid)
- SMILES
- OS(O)(=O)=O.OS(O)(=O)=O.OS(O)(=O)=O.NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
- External Links
- ChemSpider
- 24603474
- ChEMBL
- CHEMBL3188205
- Predicted Properties
Property Value Source Water Solubility 64.7 mg/mL ALOGPS logP -2.8 ALOGPS logP -8.4 Chemaxon logS -0.98 ALOGPS pKa (Strongest Acidic) 12.29 Chemaxon pKa (Strongest Basic) 9.73 Chemaxon Physiological Charge 6 Chemaxon Hydrogen Acceptor Count 19 Chemaxon Hydrogen Donor Count 13 Chemaxon Polar Surface Area 353.11 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 135.9 m3·mol-1 Chemaxon Polarizability 60.42 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon