이름: 1α,3β-Bis(tert-butyldimethylsilyloxy)-20-{4-ethyl-4-triethylsilyloxy-(2Z)-hexenyloxy}-20-methylpregna-5,7,16-triene
SMILES:
CCC(CC)(C/C=C\OC(C)(C)C1=CC[C@H]2C3=CC=C4C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H](O[Si](C)(C)C(C)(C)C)[C@]4(C)[C@H]3CC[C@]12C)O[Si](CC)(CC)CCMolecular Processing
Molecular formula
C48H88O4Si3
Molecular weight
813.49
Exact mass
812.599
XLogP
15.08
TPSA
36.92
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
16
Heavy atoms
55
Rings
4
Aromatic rings
0
Saturated rings
2
Aliphatic rings
4
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
245.18
Supplementary Information
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