CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)O)C)O[Si](C)(C)C)F)C
Название: [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-17-hydroxy-10,13,16-trimethyl-3-oxo-11-trimethylsilyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)O)C)O[Si](C)(C)C)F)C

Molecular Processing

Molecular formula
C27H39FO6Si
Molecular weight
506.69
Exact mass
506.25
XLogP
4.33
TPSA
89.9
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
35
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
8
Undefined stereo
8
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.741
Molar refractivity
131.7

Supplementary Information

InChIKey: AKORXZJFSXRDHM-RJSQOEHGSA-N
Синонимы
SCHEMBL3616828AKORXZJFSXRDHM-RJSQOEHGSA-N(11beta,16beta)-9-fluoro-17-hydroxy-16-methyl-3,20-dioxo-11-[(trimethyl-silyl)oxy]-pregna-1,4-dien-21-yl acetate(11beta,16beta)-9-fluoro-17-hydroxy-16-methyl-3,20-dioxo-11-[(trimethylsilyl)oxy]-pregna-1,4-dien-21-yl acetate
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