Oxacillin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 43
Total Number of Articles : 63
PubChem 6196
Molecular Formula

C19H19N3O5S

SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O

InChI

InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/t13-,14+,17-/m1/s1

synonyms
  • oxacillin
  • Oxazocillin
  • 66-79-5
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Properties
Property Value
MW 401.4 g/mol
HBD 2
HBA 7
Rotatable Bond Count 4
Exact Mass 401.10454189 g/mol
Monoisotopic Mass 401.10454189 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 681
xlogp 2.4
Topological Polar Surface Area 138