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53290-01-0 | 17β-Hydroxyestr-4-en-3-one O-(2-pyridyl)oxime
CAS No: 53290-01-0 Catalog No: AG00DYGG MDL No:
Product Description
Catalog Number:
AG00DYGG
Chemical Name:
17β-Hydroxyestr-4-en-3-one O-(2-pyridyl)oxime
CAS Number:
53290-01-0
IUPAC Name:
(3E,17S)-13-methyl-3-pyridin-2-yloxyimino-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
InChI:
InChI=1S/C23H30N2O2/c1-23-12-11-18-17-8-6-16(25-27-22-4-2-3-13-24-22)14-15(17)5-7-19(18)20(23)9-10-21(23)26/h2-4,13-14,17-21,26H,5-12H2,1H3/b25-16+/t17?,18?,19?,20?,21-,23?/m0/s1
InChI Key:
SUUBVPGZEBSFBG-ILQWRCSMSA-N
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
366.231g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
366.505g/mol
Monoisotopic Mass:
366.231g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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