Cefoxitin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 51
Total Number of Articles : 89
PubChem 441199
Molecular Formula

C16H17N3O7S2

SMILES

CO[C@@]1([C@@H]2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)O)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C16H17N3O7S2/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22)/t14-,16+/m1/s1

synonyms
  • cefoxitin
  • 35607-66-0
  • Mefoxin
Click to show/hide the synonyms
Properties
Property Value
MW 427.5 g/mol
HBD 3
HBA 9
Rotatable Bond Count 8
Exact Mass 427.05079224 g/mol
Monoisotopic Mass 427.05079224 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 744
xlogp 0
Topological Polar Surface Area 202