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Molecule record

(6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C15H14ClN3O4S

367.81 g/mol

Loading structure

Molecular properties

Formula
C15H14ClN3O4S
Molar mass
367.81 g·mol−1
Exact mass
367.0394 Da
10
PubChem CID
51039

Functional groups

Alkane / alkyl carbon
Alkene
Amide
Aromatic ring
Carboxylic acid
Primary amine
Secondary amine
Sulfide
Tertiary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • (6R,7R)-7-[(2R)-2-amino-2-phenylacetamido]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
  • 258-909-5
  • 3-Chloro-7-D-(2-phenylglycinamido)-3-cephem-4-carboxylic acid
  • 3Z6FS3IK0K
  • 53994-73-3
  • 69K7K19H4L
  • Bacticlor mr
  • CHEBI:3478
Show all 24 synonyms
  • COMPOUND 99638
  • Ceclor
  • Ceclor CD
  • Cefaclor anhydrous
  • Cefaclor hydrate
  • Cefaclorum
  • Cephaclor
  • DTXCID002748
  • DTXSID3022748
  • Distaclor mr
  • Keftid
  • Lilly 99638
  • Raniclor
  • RefChem:124193
  • S 6472
  • cefaclor

Structure identifiers

Canonical SMILES
N[C@@H](C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(Cl)CS[C@H]12)c1ccccc1
Isomeric SMILES
C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)Cl
InChI
InChI=1S/C15H14ClN3O4S/c16-8-6-24-14-10(13(21)19(14)11(8)15(22)23)18-12(20)9(17)7-4-2-1-3-5-7/h1-5,9-10,14H,6,17H2,(H,18,20)(H,22,23)/t9-,10-,14-/m1/s1
InChIKey
QYIYFLOTGYLRGG-GPCCPHFNSA-N
PubChem CID
51039

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record