CEFUROXIME

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Trade Names
Synonyms
Status
Molecule Category Free-form
ATC J01DC02 S01AA27
UNII O1R9FJ93ED

Structure

InChI Key JFPVXVDWJQMJEE-IZRZKJBUSA-N
Smiles CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(N)=O)CS[C@H]12)c1ccco1
InChI
InChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H16N4O8S
Molecular Weight 424.39
AlogP -0.54
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 7.0
Polar Surface Area 173.76
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 29.0

Related Entries

Cross References

Resources Reference
ChEBI 3515
ChEMBL CHEMBL1436
DrugBank DB01112
DrugCentral 565
FDA SRS O1R9FJ93ED
Human Metabolome Database HMDB0015244
Guide to Pharmacology 10900
KEGG C06894
PDB KOV
PubChem 5479529
SureChEMBL SCHEMBL1821942
ZINC ZINC000003871978
CONTENTS