(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one
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![(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dc6c970cfc464ee79148b59805dd57fa.png "(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one")
(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one
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CAS No:
47466-17-1
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Formula:
C22H25N2O2+
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Chemical Name:
(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one
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Synonyms:
N-methylstrychnine;N-methylstrychnine hydrochloride;N-Methylstrychnine;NSC 99428;Strychnidinium, 19-methyl-10-oxo-
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CAS No:
(4aR,5aS,13aS,15aS,15bR)-6-methyl-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one Basic Attributes
349.4 g/mol
349.191603044 g/mol
Computed Properties
Molecular Weight:349.4
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Exact Mass:349.191603044
Monoisotopic Mass:349.191603044
Topological Polar Surface Area:29.5
Heavy Atom Count:26
Formal Charge:1
Complexity:734
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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