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Chemistry

Mol. Mass

490.52

ALogP

-0.04

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cn1nnnc1SCC2=C(N3[C@H](SC2)[C@H](NC(=O)[C@H](OC=O)c4ccccc4)C3=O)C(=O)O
  • InChIKey: RRJHESVQVSRQEX-SUYBPPKGSA-N
    InChI=1S/C19H18N6O6S2/c1-24-19(21-22-23-24)33-8-11-7-32-17-12(16(28)25(17)13(11)18(29)30)20-15(27)14(31-9-26)10-5-3-2-4-6-10/h2-6,9,12,14,17H,7-8H2,1H3,(H,20,27)(H,29,30)/t12-,14-,17-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201218   ChEMBL

CHEMBL1146   ChEMBL
cefamandole

CHEMBL1618   ChEMBL
cefamandole nafate

5CKP8C2LLI   NCATS
cefamandole *

Cefamandole   Wikipedia

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