CC(CO)NC(=O)c1cc2c(cc1O)OCO2
SMILES: CC(CO)NC(=O)c1cc2c(cc1O)OCO2

Molecular Processing

Molecular formula
C11H13NO5
Molecular weight
239.23
Exact mass
239.0794
XLogP
0.23
TPSA
88.02
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
58.24

Supplementary Information

詳細情報を取得中…

3 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→