phloroglucinol

Synonyms: "1,3,5-benzenetriol", "1,3,5-trihydroxybenzene", "phloroglucin", "phloroglucine", "spasfon-lyoc", "benzene-S-triol"

Source: phloroglucinol is a trihydroxybenzene with antithrombotic, profibrinolytic, antimicrobial, antimalarial, cancer chemopreventive, anti-HIV and anti-leishmanial activities.

Identifiers:

IUPAC Name: benzene-1,3,5-triol
CAS Number: 108-73-6
PubChem ID: 359
InChiKey: QCDYQQDYXPDABM-UHFFFAOYSA-N
Canonical SMILES: C1=C(C=C(C=C1O)O)O

Structural Properties:

Molecular Formula: C₆H₆O₃
Molecular Weight: 126.110

Pharmacophore Features:

Number of bond donors: 3
Number of bond acceptors: 3
Number of atoms different from hydrogen: 9

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3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Arnott DG, Doniach I. 1952. The effect of compounds allied to resorcinol upon the uptake of radioactive iodine by the thyroid of the rat. Biochem J 50(4):473-479.

Lindsay RH, Hill JB, Gaitan E, Cooksey RC, Jolley RL. 1992. Antithyroid effects of coal-derived pollutants. J Toxicol Environ Health 37(4):467-481.