Pregnan-20-one, 3-hydroxy-, (3a,5b)-


Chemical Name: Pregnan-20-one, 3-hydroxy-, (3a,5b)-
CAS Number: 128-20-1
Product Number: AG000XO1(AGN-PC-0O0UMH)
Synonyms:
MDL No:
Molecular Formula: C21H34O2
Molecular Weight: 318.4935

Identification/Properties


Computed Properties
Molecular Weight:
318.501g/mol
XLogP3:
4.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
318.256g/mol
Monoisotopic Mass:
318.256g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
500
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
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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