Metoserpate hydrochloride

Base Information

• Chemical Name: Metoserpate hydrochloride
• CAS No.: 1178-29-6
• Molecular Formula: C24H32 N2 O5 . Cl H
• Molecular Weight: 465.04
• UNII: KBO7409339
• DSSTox Substance ID: DTXSID6046846
• Wikidata: Q27282167
• NCI Thesaurus Code: C76955
• ChEMBL ID: CHEMBL2106943
• Mol file: 1178-29-6.mol

Synonyms:2,3 alpha-11-trimethoxy-yohimban-1-carbonic acid methylester;2,3 alpha-11-trimethoxyyohimban-1-carbonic acid methylester;metoserpate;metoserpate monohydrochloride, (3beta,16beta,17alpha,18alpha,20alpha)-isomer;metoserpate monohydrochloride, (3beta,16beta,17alpha,18beta,20alpha)-isomer;Pacitran;Su 9064

Chemical Property of Metoserpate hydrochloride

Chemical Property:

• Vapor Pressure: 7.46E-13mmHg at 25°C
• Boiling Point: 566.5°C at 760 mmHg
• Flash Point: 296.4°C
• PSA: 73.02000
• LogP: 3.67460
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 464.2077999
• Heavy Atom Count: 32
• Complexity: 662

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1CC2CN3CCC4=C(C3CC2C(C1OC)C(=O)OC)NC5=C4C=CC(=C5)OC.Cl
• Isomeric SMILES: CO[C@H]1C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]([C@H]1OC)C(=O)OC)NC5=C4C=CC(=C5)OC.Cl
• Uses: Sedative (veterinary).