2,7-Dihydrohomoerysotrine

Base Information

• Chemical Name: 2,7-Dihydrohomoerysotrine
• CAS No.: 51095-85-3
• Molecular Formula: C20H27NO3
• Molecular Weight: 329.4333
• NSC Number: 166069
• DSSTox Substance ID: DTXSID60304511
• Nikkaji Number: J710.360C
• Wikidata: Q72465106
• ChEMBL ID: CHEMBL487209
• Mol file: 51095-85-3.mol

Synonyms:2,7-dihydrohomoerysotrine;51095-85-3;(1S,17S)-4,5,17-trimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraene;Homoerysotrine,2,7-dihydro-;NSC 166069;CHEMBL487209;DTXSID60304511;HY-N1681;NSC166069;AKOS032948726;FS-9944;NSC-166069;CS-0017343;B602425K094;C-Homoerythrinan,6-didehydro-3,15,16-trimethoxy-, (3.beta.)-

Chemical Property of 2,7-Dihydrohomoerysotrine

Chemical Property:

• Vapor Pressure: 1.36E-08mmHg at 25°C
• Boiling Point: 458.5°C at 760 mmHg
• Flash Point: 132°C
• PSA: 30.93000
• Density: 1.17g/cm³
• LogP: 3.22410
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 329.19909372
• Heavy Atom Count: 24
• Complexity: 493

Purity/Quality:

98%min ^*data from raw suppliers

2,7-Dihydrohomoerysotrine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1CC=C2CCN3C2(C1)C4=CC(=C(C=C4CCC3)OC)OC
• Isomeric SMILES: CO[C@H]1CC=C2CCN3[C@]2(C1)C4=CC(=C(C=C4CCC3)OC)OC