Ceftriaxone

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 262
Total Number of Articles : 428
PubChem 12971801
Molecular Formula

C18H18N8O7S3

SMILES

CN1C(=NC(=O)C(=O)N1)SCC2=C(N3C([C@@H](C3=O)NC(=O)/C(=N/OC)/C4=CSC(=N4)N)SC2)C(=O)O

InChI

InChI=1S/C18H18N8O7S3/c1-25-18(22-12(28)13(29)23-25)36-4-6-3-34-15-9(14(30)26(15)10(6)16(31)32)21-11(27)8(24-33-2)7-5-35-17(19)20-7/h5,9,15H,3-4H2,1-2H3,(H2,19,20)(H,21,27)(H,23,29)(H,31,32)/b24-8+/t9-,15?/m1/s1

synonyms
  • ceftriaxone
  • CEFTRIAXONE SODIUM
  • AKOS016360025
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Properties
Property Value
MW 554.6 g/mol
HBD 4
HBA 13
Rotatable Bond Count 8
Exact Mass 554.04605846 g/mol
Monoisotopic Mass 554.04605846 g/mol
Heavy Atom Count 36
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 1110
xlogp -1.3
Topological Polar Surface Area 288