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Product Overview

Product Code

TRC-B382908

CAS Number

37134-40-0

Product Format

Neat

Molecular Formula

C19 H22 N2 O8

Molecular Weight

406.39

Product Categories

TRC, Other antibacterials, Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive Small Molecule

Documentation

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Product Information

Chemical Data

Analyte Name

Bicyclomycin Benzoate

CAS Number

37134-40-0

Molecular Formula

C19 H22 N2 O8

Molecular Weight

406.39

Accurate Mass

406.1376

SMILES

[C@@H]([C@@](COC(=O)C1=CC=CC=C1)(C)O)(O)[C@]23C(=O)N[C@](O)(C(=O)N2)C(=C)CCO3

InChI

InChI=1S/C19H22N2O8/c1-11-8-9-29-19(16(25)20-18(11,27)15(24)21-19)14(23)17(2,26)10-28-13(22)12-6-4-3-5-7-12/h3-7,14,23,26-27H,1,8-10H2,2H3,(H,20,25)(H,21,24)/t14-,17-,18+,19-/m0/s1

IUPAC

[(2S,3S)-2,3-dihydroxy-3-[(1S,6R)-6-hydroxy-5-methylene-8,10-dioxo-2-oxa-7,9-diazabicyclo[4.2.2]decan-1-yl]-2-methyl-propyl] benzoate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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