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Product Overview

Product Code

TRC-O856850

CAS Number

39707-61-4

Product Format

Neat

Molecular Formula

C19H17N7O7

Molecular Weight

455.38

API Family

Folic Acid

Product Categories

TRC, Food and Beverage Reference Materials, Vitamins, Vitamins and derivatives, Impurity Reference Materials , Vitamins and derivatives, API Reference Standards & Research Materials

Product Type

Impurity, API, Contaminant

Purity

>95% (HPLC)

Drug Type

Vitamins & Derivatives

Documentation

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Product Information

Chemical Data

Analyte Name

9-Oxofolic Acid

CAS Number

39707-61-4

Molecular Formula

C19H17N7O7

Molecular Weight

455.38

Accurate Mass

455.1189

SMILES

O=C1C2=NC(C(NC3=CC=C(C(N[C@@H](CCC(O)=O)C(O)=O)=O)C=C3)=O)=CNC2=NC(N)=N1

InChI

InChI=1S/C19H17N7O7/c20-19-25-14-13(17(31)26-19)23-11(7-21-14)16(30)22-9-3-1-8(2-4-9)15(29)24-10(18(32)33)5-6-12(27)28/h1-4,7,10H,5-6H2,(H,22,30)(H,24,29)(H,27,28)(H,32,33)(H3,20,21,25,26,31)/t10-/m0/s1

IUPAC

(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridine-6-carbonyl)amino]benzoyl]amino]pentanedioic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Folic Acid

Purity

>95% (HPLC)

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