Estrone

Synonyms: estrone, "folliculin", "OESTRONE", "Theelin", "estrovarin", "Estrugenone", "follicular hormone", "Kestrone", "Estron", "Follicunodis", "Oestroperos", "Oestroform", "Hiestrone", "Glandubolin", "Folliculine", "Disynformon", "Destrone", "Thelykinin", "Oestronum", "Aquacrine", "Hormestrin", "Menagen", "Oestrin", "Folisan", "Folipex", "Femidyn", "Kolpon", "Unden", "Ketohydroxyestrin", "Ketohydroxyoestrin", "Estrone-A", "Endofolliculina", "Perlatan", "Mestronaq", "Ovifollin", "Ketodestrin", "Follestrine", "Wynestron", "Thynestron", "Solliculin", "Menformon", "Hormovarine", "Follestrol", "Folikrin", "Estrusol", "Crystogen", "Cristallovar".

Source: Estrone is used to control symptoms associated with menopause and perimenopause.

Identifiers:

IUPAC Name: (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS Number: 53-16-7
PubChem ID: 5870
InChiKey: DNXHEGUUPJUMQT-CBZIJGRNSA-N
Canonical SMILES: CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)O

Structural Properties:

Molecular Formula: C₁₈H₂₂O₂
Molecular Weight: 270.4

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 2
Number of atoms different from hydrogen: 20

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Evidence Supporting This Chemical as an Emerging Contaminant

Kapelewska, J., Kotowska, U., Karpi?ska, J., Kowalczuk, D., Arciszewska, A., & Swirydo, A. (2018). Occurrence, removal,mass loading and environmental risk assessment of emerging organic contaminants in leachates, groundwaters and wastewaters. Microchemical Journal 137, 292?301.

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2D-structure

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