Propylthiouracil N-beta-D-glucuronide

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Catalog Number

ACM33987245

Product Name

Structure

CAS

33987-24-5

Category

Heterocyclic Organic Compound

Synonyms

1-Deoxy-1-(3,4-dihydro-4-oxo-6-propyl-2-thioxo-1(2H)-pyrimidinyl)- β-D-Glucopyranuronic Acid;

IUPAC Name

(3R,6R)-3,4,5-trihydroxy-6-(4-oxo-6-propyl-2-sulfanylidenepyrimidin-1-yl)oxane-2-carboxylic acid

Molecular Weight

346.36

Molecular Formula

C₁₃H₁₈N₂O₇S

Canonical SMILES

CCCC1=CC(=O)NC(=S)N1C2C(C(C(C(O2)C(=O)O)O)O)O

InChI Key

FRRSJAKAIDIIKX-PBPDKXIHSA-N

Melting Point

170-172ºC (dec.)

Appearance

Off-White Solid

Exact Mass

346.08300

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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