Speciophylline
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Speciophylline
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CAS No:
4697-68-1
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Formula:
C21H24N2O4
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Chemical Name:
Speciophylline
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Synonyms:
Spiro[3H-indole-3,6′(4′aH)-[1H]pyrano[3,4-f]indolizine]-4′-carboxylic acid,1,2,5′,5′a,7′,8′,10′,10′a-octahydro-1′-methyl-2-oxo-,methyl ester,(1′S,3S,4′aS,5′aR,10′aS)-;Speciophylline;Formosanan-16-carboxylic acid,19-methyl-2-oxo-,methyl ester,(3β,7α,19α,20α)-;Uncarine D;Speciophyllin;Uncarin D;Spiro[3H-indole-3,6′(4′aH)-[1H]pyrano[3,4-f]indolizine]-4′-carboxylic acid,1,2,5′,5′a,7′,8′,10′,10′a-octahydro-1′-methyl-2-oxo-,methyl ester,[1′S-(1′α,4′aα,5′aβ,6′α,10′aα)]-;NSC 113094;92772-31-1
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CAS No:
Computed Properties
Molecular Weight:368.4
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:368.17360725
Monoisotopic Mass:368.17360725
Topological Polar Surface Area:67.9
Heavy Atom Count:27
Complexity:692
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes