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53224-68-3 | 17β-Hydroxyandrost-4-en-3-one O-(2-pyridyl)oxime
CAS No: 53224-68-3 Catalog No: AG00DYLY MDL No:
Product Description
Catalog Number:
AG00DYLY
Chemical Name:
17β-Hydroxyandrost-4-en-3-one O-(2-pyridyl)oxime
CAS Number:
53224-68-3
IUPAC Name:
(3Z,8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-pyridin-2-yloxyimino-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-ol
InChI:
InChI=1S/C24H32N2O2/c1-23-12-10-17(26-28-22-5-3-4-14-25-22)15-16(23)6-7-18-19-8-9-21(27)24(19,2)13-11-20(18)23/h3-5,14-15,18-21,27H,6-13H2,1-2H3/b26-17-/t18-,19-,20-,21-,23-,24-/m0/s1
InChI Key:
DIXJUEUWJYXSHE-YZBWEKTASA-N
Properties
Complexity:
674
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
6
Defined Bond Stereocenter Count:
1
Exact Mass:
380.246g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
380.532g/mol
Monoisotopic Mass:
380.246g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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