Product Code

TRC-C981960

CAS Number

56796-16-8

Product Format

Neat

Molecular Formula

C15 H17 N3 O7 S2

Molecular Weight

415.441

Product Categories

TRC

Product Type

Impurity

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

7-((((Cyanomethyl)thio)acetyl)amino)-7-methoxy Cephalosporanic Acid

CAS Number

56796-16-8

Molecular Formula

C15 H17 N3 O7 S2

Molecular Weight

415.441

Accurate Mass

415.051

SMILES

CO[C@]1(NC(=O)CSCC#N)[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)C

InChI

InChI=1S/C15H17N3O7S2/c1-8(19)25-5-9-6-27-14-15(24-2,17-10(20)7-26-4-3-16)13(23)18(14)11(9)12(21)22/h14H,4-7H2,1-2H3,(H,17,20)(H,21,22)/t14-,15+/m1/s1

IUPAC

(6R,7S)-3-(acetyloxymethyl)-7-[[2-(cyanomethylsulfanyl)acetyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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7-[[[(Cyanomethyl)thio]acetyl]amino]-7-methoxy Cephalosporanic Acid

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