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Product Overview

Product Code

TRC-A745005

Product Format

Neat

Molecular Formula

C32 H36 N6 O9 S2

Molecular Weight

712.793

API Family

Amoxicillin

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Documentation

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Product Information

Chemical Data

Analyte Name

Amoxicillin Closed-loop Dimer

Molecular Formula

C32 H36 N6 O9 S2

Molecular Weight

712.793

Accurate Mass

712.199

SMILES

CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)[C@@H]3N4[C@H](SC3(C)C)[C@H](NC(=O)[C@H](N)c5ccc(O)cc5)C4=O)c6ccc(O)cc6)C(=O)N2[C@H]1C(=O)O

InChI

InChI=1S/C32H36N6O9S2/c1-31(2)21(37-26(44)19(28(37)48-31)35-23(41)17(33)13-5-9-15(39)10-6-13)25(43)34-18(14-7-11-16(40)12-8-14)24(42)36-20-27(45)38-22(30(46)47)32(3,4)49-29(20)38/h5-12,17-22,28-29,39-40H,33H2,1-4H3,(H,34,43)(H,35,41)(H,36,42)(H,46,47)/t17-,18-,19-,20-,21+,22+,28-,29-/m1/s1

IUPAC

(2S,5R,6R)-6-[[(2R)-2-[[(2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Amoxicillin

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