Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C29H44O3
- Molecular weight
- 440.7 g/mol
- IUPAC name
- [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] undecanoate
- SMILES
- CCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C
- InChIKey
- TXHUMRBWIWWBGW-GVGNIZHQSA-N
- XLogP
- 9.2
- Polar surface area
- 46.5 Ų
- 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
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 440.329
Show 4 more facts
- chemical formula
- C₂₉H₄₄O₃
- isomeric SMILES
- CCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C
- canonical SMILES
- CCCCCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C
- Commons category
- Estradiol undecylate
Sources (2)
via Wikidata · CC0