Cholest-4-en-3-one, 7,12-dihydroxy-, (7a,12a)-


Chemical Name: Cholest-4-en-3-one, 7,12-dihydroxy-, (7a,12a)-
CAS Number: 1254-03-1
Product Number: AG000NMM(AGN-PC-0O0QKP)
Synonyms:
MDL No:
Molecular Formula: C27H44O3
Molecular Weight: 416.6365

Identification/Properties


Computed Properties
Molecular Weight:
416.646g/mol
XLogP3:
6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
416.329g/mol
Monoisotopic Mass:
416.329g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
696
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
9
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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