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Home > Boronic Acids > 55429-59-9
55429-59-9 | Pregnane-17,20-diol, 3-[(trimethylsilyl)oxy]-, cyclic (1,1-dimethyleth yl)boronate, (3alpha,5beta,20S)-
CAS No: 55429-59-9 Catalog No: AG00E5GS MDL No:
Product Description
Catalog Number:
AG00E5GS
Chemical Name:
Pregnane-17,20-diol, 3-[(trimethylsilyl)oxy]-, cyclic (1,1-dimethyleth yl)boronate, (3alpha,5beta,20S)-
CAS Number:
55429-59-9
IUPAC Name:
[(3R,5R,5'S,8R,9S,10S,13S,14S,17R)-2'-tert-butyl-5',10,13-trimethylspiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,4'-1,3,2-dioxaborolane]-3-yl]oxy-trimethylsilane
InChI:
InChI=1S/C28H51BO3Si/c1-19-28(32-29(30-19)25(2,3)4)17-14-24-22-11-10-20-18-21(31-33(7,8)9)12-15-26(20,5)23(22)13-16-27(24,28)6/h19-24H,10-18H2,1-9H3/t19-,20+,21+,22+,23-,24-,26-,27-,28-/m0/s1
InChI Key:
MYYOGQMZJSAPCG-DMGVUSMOSA-N
Properties
Complexity:
761
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
9
Defined Bond Stereocenter Count:
0
Exact Mass:
474.37g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.608g/mol
Monoisotopic Mass:
474.37g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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