2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)-
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![2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ff0100120c1747d486d44744720aecf7.png "2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)-")
2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)-
structure -
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CAS No:
2299-26-5
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Formula:
C21H26N2O3
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Chemical Name:
2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)-
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Synonyms:
2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid,5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-,methyl ester,(2S,5R,6S,14S)-;Dregamine;Vobasan-17-oic acid,19,20-dihydro-3-oxo-,methyl ester,(20α)-;2,6-Methano-1H-azecino[5,4-b]indole,vobasan-17-oic acid deriv.;20-Epitabernemontanine;(-)-Dregamine;NSC 177392
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CAS No:
2,6-Methano-1H-azecino[5,4-b]indole-14-carboxylic acid, 5-ethyl-2,3,4,5,6,7,8,9-octahydro-3-methyl-8-oxo-, methyl ester, (2S,5R,6S,14S)- Basic Attributes
354.4 g/mol
354.44
218-948-0|218-367-2
Computed Properties
Molecular Weight:354.4
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:354.19434270
Monoisotopic Mass:354.19434270
Topological Polar Surface Area:62.4
Heavy Atom Count:26
Complexity:566
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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