buxaminol E
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buxaminol E
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CAS No:
14155-76-1
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Formula:
C26H44N2O
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Chemical Name:
buxaminol E
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Synonyms:
buxaminol E;CTK4C2681;DTXSID20931120;20-Amino-3-(dimethylamino)-4,4,14-trimethyl-9,19-cyclo-9,10-secopregna-9(11),10-dien-16-ol;B(9a)-Homo-19-norpregna-9(11),9a-dien-16-ol, 20-amino-3-(dimethylamino)-4,4,14-trimethyl-, (3beta,5alpha,16alpha,20S)-;Benzo[4,5]cyclohept[1,2-e]inden-2-ol,3-[(1S)-1-aminoethyl]-9-(dimethylamino)-1,2,3,3a,4,7,8,9,10,10a,11,12,12a,12b-tetradecahydro-3a,10,10,12b-tetramethyl-,(2R,3S,3aR,9S,10aR,12aR,12bS)-
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CAS No:
Computed Properties
Molecular Weight:400.6
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:400.345364031
Monoisotopic Mass:400.345364031
Topological Polar Surface Area:49.5
Heavy Atom Count:29
Complexity:722
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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