Substance
- Substance Name: Cefoxitin
- Formula: C16H17N3O7S2
- Molecular Weight: 427.5 g/mol
- Identifiers:
- inchi: InChI=1S/C16H17N3O7S2/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22)/t14-,16+/m1/s1
- inchikey: WZOZEZRFJCJXNZ-ZBFHGGJFSA-N
- casrn: 35607-66-0
- csmiles: COC1(C2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)O)NC(=O)CC3=CC=CS3
- ismiles: CO[C@@]1([C@@H]2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)O)NC(=O)CC3=CC=CS3
- pubchemId: 441199
- iupacname: (6R,7S)-3-(carbamoyloxymethyl)-7-methoxy-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- wikidataId: Q2353907
- chemspiderId: 389981
- dsstoxcmpId: DTXCID002764
- chemblId: CHEMBL996
- ecnumber: 252-641-2
Cefoxitin
Systems and Datasets
- methanol + Cefoxitin (Datasets: 1)
- Dataset 1 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- ethyl acetate + Cefoxitin (Datasets: 1)
- Dataset 2 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- acetonitrile + Cefoxitin (Datasets: 1)
- Dataset 3 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- propan-1-ol + Cefoxitin (Datasets: 1)
- Dataset 4 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- propan-2-ol + Cefoxitin (Datasets: 1)
- Dataset 5 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- ethanol + Cefoxitin (Datasets: 1)
- Dataset 6 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- methanol + water + Cefoxitin (Datasets: 1)
- Dataset 7 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 7, Datapoints: 49, Quantity: Mole fraction)
- water + Cefoxitin (Datasets: 1)
- Dataset 8 in paper 10.1016/j.jct.2016.07.049 (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)