N-methylfunaltrexamine
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N-methylfunaltrexamine
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CAS No:
83339-80-4
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Formula:
C25H30N2O6
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Chemical Name:
N-methylfunaltrexamine
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Synonyms:
N-methyl-alpha-funaltrexamine;N-methyl-beta-funaltrexamine;N-methylfunaltrexamine;CHEMBL2364558;2-Butenoic acid, 4-(((5alpha,6alpha)-17-(cyclopropylmethyl)-4,5-epoxy-3,14-dihydroxymorphinan-6-yl)amino)-4-oxo-, methyl ester, (E)-
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CAS No:
Computed Properties
Molecular Weight:454.5
XLogP3:-0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:454.21038668
Monoisotopic Mass:454.21038668
Topological Polar Surface Area:108
Heavy Atom Count:33
Complexity:860
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes