7(alpha-Fluoro-2-thienylacetamido)cephalosporanic acid - 94788-69-9

7(alpha-Fluoro-2-thienylacetamido)cephalosporanic acid

Catalog Number: EVT-1535923
CAS Number: 94788-69-9
Molecular Formula: C16H15FN2O6S2
Molecular Weight: 414.4 g/mol
The product is for non-human research only. Not for therapeutic or veterinary use.

Product Introduction

Properties

CAS Number

94788-69-9

Product Name

7(alpha-Fluoro-2-thienylacetamido)cephalosporanic acid

IUPAC Name

(7R)-3-(acetyloxymethyl)-7-[(2-fluoro-2-thiophen-2-ylacetyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Molecular Formula

C16H15FN2O6S2

Molecular Weight

414.4 g/mol

InChI

InChI=1S/C16H15FN2O6S2/c1-7(20)25-5-8-6-27-15-11(14(22)19(15)12(8)16(23)24)18-13(21)10(17)9-3-2-4-26-9/h2-4,10-11,15H,5-6H2,1H3,(H,18,21)(H,23,24)/t10?,11-,15?/m1/s1

InChI Key

SYQKPJZGUFYKJG-LOIXOFCESA-N

SMILES

CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CS3)F)SC1)C(=O)O

Synonyms

7(alpha-fluoro-2-thienylacetamido)cephalosporanic acid
L 14655
L-14655

Canonical SMILES

CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CS3)F)SC1)C(=O)O

Isomeric SMILES

CC(=O)OCC1=C(N2C([C@@H](C2=O)NC(=O)C(C3=CC=CS3)F)SC1)C(=O)O

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