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Reference substances

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IUPAC name:
7-{[amino(phenyl)acetyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Inventory

EC number:
239-773-6
EC name:
Cefalexin
CAS number:
15686-71-2
CAS number:
15686-71-2
Synonyms
Names:
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2R)-aminophenylacetyl]amino]-3-methyl-8-oxo-, (6R,7R)-

Molecular and structural information

Molecular formula:
C16H17N3O4S
Molecular weight:
347.389
SMILES notation:
CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)c3ccccc3)C2=O)C(=O)O
InChl:
InChI=1/C16H17N3O4S/c1-8-7-24-15-11(14(21)19(15)12(8)16(22)23)18-13(20)10(17)9-5-3-2-4-6-9/h2-6,10-11,15H,7,17H2,1H3,(H,18,20)(H,22,23)
Structural formula:
Chemical structure

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