이름: (1S,3aS,5S,7aR)-1-[(E)-2-aminoethoxyimino]methyl-5-phenyl-7a-methylperhydroinden-3a-ol
SMILES:
C[C@]12CC[C@H](c3ccccc3)C[C@@]1(O)CC[C@@H]2/C=N/OCCNMolecular Processing
Molecular formula
C19H28N2O2
Molecular weight
316.45
Exact mass
316.2151
XLogP
3.06
TPSA
67.84
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
92.31
Supplementary Information
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