EINECS 258-967-1
3-(acetyloxymethyl)-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: EINECS 258-967-1|7-|A-Methoxy-|A-amidocephalosporansaeure|3-[(acetyloxy)methyl]-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|3-(acetyloxymethyl)-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R-cis)-3-(Acetoxymethyl)-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid|(6R)-3-acetoxymethyl-7t-amino-7c-methoxy-8-oxo-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid|(6R-CIS)-3-(ACETOXYMETHYL)-7-AMINO-7-METHOXY-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID|3-(acetyloxymethyl)-7-azanyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
| Molecular Formula | C11H14N2O6S |
|---|---|
| Molecular Weight | 302.05725 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 119.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.05725 |
| Heavy Atoms | 20 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 54083-02-2 |
|---|---|
| SMILES | CC(=O)OCC1=C(N2C(C(C2=O)(N)OC)SC1)C(=O)O |
Product Overview
EINECS 258-967-1 (CAS 54083-02-2), with molecular formula C11H14N2O6S and molecular weight 302.05725 g/mol. IUPAC: 3-(acetyloxymethyl)-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
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