Nombre: 7β-phenoxyacetamido-3-methylthio-ceph-3-em-4-carboxylic acid
SMILES:
CC1=C(C(O)=S)N2C(=O)[C@@H](NC(=O)COc3ccccc3)[C@H]2SC1Molecular Processing
Molecular formula
C16H16N2O4S2
Molecular weight
364.45
Exact mass
364.0551
XLogP
1.62
TPSA
78.87
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
94.89
Supplementary Information
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