C[C@]12CCCCC1C[C@@H](CN)[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC13OCCOC12OCCO3
이름: 17,17-bis(ethylendioxy)-7α-aminomethylandrostane
SMILES: C[C@]12CCCCC1C[C@@H](CN)[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC13OCCOC12OCCO3

Molecular Processing

Molecular formula
C24H39NO4
Molecular weight
405.58
Exact mass
405.2879
XLogP
3.7
TPSA
62.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
29
Rings
6
Aromatic rings
0
Saturated rings
6
Aliphatic rings
6
Stereo centers
7
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
1
Molar refractivity
108.92

Supplementary Information

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