venenatine
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venenatine
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CAS No:
1055-75-0
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Formula:
C22H28N2O4
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Chemical Name:
venenatine
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Synonyms:
venenatine;Nsc339139;(3β,20α)-17β-Hydroxy-9-methoxyyohimban-16β-carboxylicacidmethylester;Yohimban-16-carboxylicacid,17-hydroxy-9-methoxy-,methylester,(3-beta,16-beta,17-beta,20-alpha)-
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CAS No:
Computed Properties
Molecular Weight:384.5
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:384.20490738
Monoisotopic Mass:384.20490738
Topological Polar Surface Area:74.8
Heavy Atom Count:28
Complexity:601
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes