N-methylnalorphine
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N-methylnalorphine
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CAS No:
4121-75-9
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Formula:
C20H24NO3+
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Chemical Name:
N-methylnalorphine
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Synonyms:
N-methylnalorphine;CHEMBL1198671;DTXSID80961504;3,6-Dihydroxy-17-methyl-17-(prop-2-en-1-yl)-7,8-didehydro-4,5-epoxymorphinan-17-ium;(4R,7S,7aR,12bS)-3-methyl-3-prop-2-enyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-3-ium-7,9-diol;Morphinanium, 7,8-didehydro-4,5-epoxy-3,6-dihydroxy-17-methyl-17-(2-propenyl)-, (5alpha,6alpha)-
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CAS No:
Computed Properties
Molecular Weight:326.4
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:326.17561863
Monoisotopic Mass:326.17561863
Topological Polar Surface Area:49.7
Heavy Atom Count:24
Formal Charge:1
Complexity:591
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes