Cefazolin-13C2,15N | Cefazolin-13C2,15N | CAS 2101505-58-0 | AnyMole

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HIT212972338

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HIT212972338

HIT ID:HIT212972338
Cas No:2101505-58-0
常用名:Cefazolin-13C2,15N
别名:Cefazolin-13C2,15N
IUPAC:(6R,7R)-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-7-{2-[(1-15N)-1H-1,2,3,4-tetrazol-1-yl](1,2-13C2)acetamido}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC:(6R,7R)-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-7-{2-[(1-15N)-1H-1,2,3,4-tetrazol-1-yl](1,2-13C2)acetamido}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChI key:MLYYVTUWGNIJIB-ZDZFQHAJSA-N

分子式:C14H14N8O4S3
分子量:457.48
氢键供体数 (HBD):2
氢键受体数 (HBA):9
LogP:-1.5194101
SMILES:Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](N[13C](=O)[13CH2][15n]2cnnn2)C3=O)C(O)=O)s1 |t:7|
SMILES:Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](N[13C](=O)[13CH2][15n]2cnnn2)C3=O)C(O)=O)s1 |t:7|

Cefazolin-13C2,15N is intended for use as an internal standard for the quantification of cefazolin by GC- or LC-MS. Cefazolin is a broad-spectrum cephalosporin antibiotic that is active in vitro against various Gram-positive and Gram-negative bacteria (MICs = 0.2-12.5 μg/ml). It also inhibits the growth of clinical isolates of S. aureus, E. coli, P. mirabilis, and K. pneumoniae (MICs = 0.1-25 μg/ml).

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