estradiol benzoate

Also known as [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate, Eston-B, estradiol 3-benzoate, oestradiol 3-benzoate, beta-estradiol 3-benzoate, oestradiol benzoate, estra-1,3,5(10)-triene-3,17beta-diol 3-benzoate, 17beta-estradiol monobenzoate

chemical compound

Chemical data

Formula: C25H28O3
Molecular weight: 376.5 g/mol
IUPAC name: [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5
InChIKey: UYIFTLBWAOGQBI-BZDYCCQFSA-N
XLogP: 4.5
Polar surface area: 46.5 Å²
H-bond donors: 1
H-bond acceptors: 3
Formal charge: 0

via PubChem

Drug data · ChEMBL

Max clinical phase: Phase 2
Molecule type: Small molecule

via ChEMBL · EBI

Research

4,793 papers

Identification of Estradiol Benzoate as an Inhibitor of HBx Using Inducible Stably Transfected HepG2 Cells Expressing HiBiT Tagged HBx.Molecules (Basel, Switzerland) · 2022
Methyl palmitate reversed estradiol benzoate-induced endometrial hyperplasia in female rats.Toxicology mechanisms and methods · 2021
Intravaginal administration of estradiol benzoate capsule for estrus synchronization in goats.The Journal of reproduction and development · 2021
Protection induced by estradiol benzoate in the MPP(+) rat model of Parkinson's disease is associated with the regulation of the inflammatory cytokine profile in the nigro striatum.Journal of neuroimmunology · 2020
The presence of estradiol benzoate in the cervical relaxation treatment for non-surgical embryo collection does not impair embryonic morphological quality, cryosurvival, and gene expression profile.Theriogenology · 2024

via PubMed

Wikidata facts

Mass: 376.203845

Show 5 more facts

chemical formula: C₂₅H₂₈O₃
canonical SMILES: CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5
isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5
World Health Organisation international non-proprietary name: estradiol benzoate
Commons category: Estradiol benzoate

Sources (3)

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