CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=NO)CC[C@@]3(O)[C@H]1C5
SMILES: CN1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=NO)CC[C@@]3(O)[C@H]1C5

Molecular Processing

Molecular formula
C17H20N2O4
Molecular weight
316.36
Exact mass
316.1423
XLogP
1.01
TPSA
85.52
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
0
Heavy atoms
23
Rings
5
Aromatic rings
1
Saturated rings
2
Aliphatic rings
4
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
82.35

Supplementary Information

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