이름: 4-methyl-4-androstene-17β,19-diol dipropionate
SMILES:
CCC(=O)OC[C@]12CCCC(C)=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](OC(=O)CC)CC[C@@H]12Molecular Processing
Molecular formula
C26H40O4
Molecular weight
416.6
Exact mass
416.2927
XLogP
5.98
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.846
Molar refractivity
116.68
Supplementary Information
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