2-hydroxyanthraquinone

Synonyms: "2-hydroxyanthraquinone", "2-hydroxyanthracene-9,10-dione", "2-hydroxy-9,10-anthraquinone", "beta-hydroxyanthraquinone", "2-hydroxy-9,10-anthracenedione", "2-hydroxyanthra-9,10-quinone", "hydroxy-9,10-anthracenedione", "2-hydroxy-anthraquinone".

Source: 2-hydroxyanthraquinone is the major anthraquinone metabolite.

Identifiers:

IUPAC Name: 2-hydroxyanthracene-9,10-dione
CAS Number: 605-32-3
PubChem ID: 11796
InChiKey: GCDBEYOJCZLKMC-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)O

Structural Properties:

Molecular Formula: C14H8O3
Molecular Weight: 224.215

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 17

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Evidence Supporting This Chemical as an Endocrine Disruptor
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Kurihara R, Shiraishi F, Tanaka N, Hashimoto S. 2005. Presence and estrogenicity of anthracene derivatives in coastal Japanese waters. Environ Toxicol Chem 24(8):1984-1993. DOI: 10.1897/04-310R.1. URL: http://onlinelibrary.wiley.com/doi/10.1897/04-310R.1/abstract.

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