panipenem

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 9
Total Number of Articles : 11
PubChem 72015
Molecular Formula

C15H21N3O4S

SMILES

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)S[C@H]3CCN(C3)C(=N)C)O

InChI

InChI=1S/C15H21N3O4S/c1-7(19)12-10-5-11(13(15(21)22)18(10)14(12)20)23-9-3-4-17(6-9)8(2)16/h7,9-10,12,16,19H,3-6H2,1-2H3,(H,21,22)/t7-,9+,10-,12-/m1/s1

synonyms
  • panipenem
  • 87726-17-8
  • Carbapenem RS-533
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Properties
Property Value
MW 339.4 g/mol
HBD 3
HBA 6
Rotatable Bond Count 5
Exact Mass 339.12527733 g/mol
Monoisotopic Mass 339.12527733 g/mol
Heavy Atom Count 23
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 606
xlogp 0
Topological Polar Surface Area 130