cedrelone
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cedrelone
structure -
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CAS No:
1254-85-9
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Formula:
C26H30O5
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Chemical Name:
cedrelone
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Synonyms:
cedrelone;SCHEMBL20398123;DTXSID60925124;AKOS032948454;17-(Furan-3-yl)-6-hydroxy-4,4,8-trimethyl-14,15-epoxyandrosta-1,5-diene-3,7-dione
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CAS No:
Characteristics
80.04000
3.85
1.30±0.1 g/cm3(Predicted)
204 °C
584.2±50.0 °C(Predicted)
307.1±30.1 °C
1.618
Computed Properties
Molecular Weight:422.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:422.20932405
Monoisotopic Mass:422.20932405
Topological Polar Surface Area:80
Heavy Atom Count:31
Complexity:976
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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