O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21
名称: clavulanic acid
SMILES: O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21

Molecular Processing

Molecular formula
C8H9NO5
Molecular weight
199.16
Exact mass
199.0481
XLogP
-1.1
TPSA
87.07
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
42.93

Supplementary Information

No supplementary data available

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