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Product Overview

Product Code

TRC-I790000

CAS Number

514-53-4

Product Format

Neat

Molecular Formula

C22 H23 Cl N2 O8

Molecular Weight

478.88

API Family

Chlortetracycline

Product Categories

Antibiotics, TRC, Antibiotics, Pharmaceutical Reference Standards, Tetracyclines, Interferes with protein synthesis, Antibacterial, Antibacterial, Antibiotics, Antibacterial, Tetracyclines

Product Type

Bioactive small molecule, Metabolite

Drug Type

Antibacterials

Documentation

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Product Information

Chemical Data

Analyte Name

Isochlortetracycline

CAS Number

514-53-4

Molecular Formula

C22 H23 Cl N2 O8

Molecular Weight

478.88

Accurate Mass

478.1143

Flash Point

-20

SMILES

CN(C)[C@H]1[C@@H]2C[C@@H](CC(=O)[C@]2(O)C(=O)C(=C1O)C(=O)N)[C@]3(C)OC(=O)c4c(O)ccc(Cl)c34

InChI

InChI=1S/C22H23ClN2O8/c1-21(15-10(23)4-5-11(26)13(15)20(31)33-21)8-6-9-16(25(2)3)17(28)14(19(24)30)18(29)22(9,32)12(27)7-8/h4-5,8-9,16,26,28,32H,6-7H2,1-3H3,(H2,24,30)/t8-,9-,16-,21-,22-/m0/s1

IUPAC

(4S,4aS,6S,8aS)-6-[(1S)-7-chloro-4-hydroxy-1-methyl-3-oxo-2-benzofuran-1-yl]-4-(dimethylamino)-3,8a-dihydroxy-1,8-dioxo-4a,5,6,7-tetrahydro-4H-naphthalene-2-carboxamide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Chlortetracycline

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