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75601-28-4 | 1-Methyl-1H-imidazol-2-yl[(4bS)-4b,5,6,7,8,8aβ,9,10-octahydro-4bα,8α-dimethyl-2-(1-methylethyl)phenanthren-9-yl] ketone
CAS No: 75601-28-4 Catalog No: AG00GG2A MDL No:
Product Description
Catalog Number:
AG00GG2A
Chemical Name:
1-Methyl-1H-imidazol-2-yl[(4bS)-4b,5,6,7,8,8aβ,9,10-octahydro-4bα,8α-dimethyl-2-(1-methylethyl)phenanthren-9-yl] ketone
CAS Number:
75601-28-4
IUPAC Name:
[(4bS,8S,8aR)-4b,8-dimethyl-2-propan-2-yl-6,7,8,8a,9,10-hexahydro-5H-phenanthren-9-yl]-(1-methylimidazol-2-yl)methanone
InChI:
InChI=1S/C24H32N2O/c1-15(2)17-8-9-20-18(13-17)14-19(22(27)23-25-11-12-26(23)5)21-16(3)7-6-10-24(20,21)4/h8-9,11-13,15-16,19,21H,6-7,10,14H2,1-5H3/t16-,19?,21+,24+/m0/s1
InChI Key:
AZTZXTOBMJBOHE-ZTUAAECQSA-N
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
364.251g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.533g/mol
Monoisotopic Mass:
364.251g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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