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Basic information
- CAS
28956-89-0- Standard SMILES
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(OC(=O)c1ccccc1)C(=O)CO- InChIKey
LPEYMYDYPGRLBU-YGZHYJPASA-N- Molecular formula
- C28H34O6
- Average molar mass
- 466.574 g/mol
- Monoisotopic mass
- 466.23553881
Names & identifiers
- Preferred name
- Benzodrocortisone
- IUPAC
- 11beta,21-Dihydroxy-3,20-dioxopregn-4-en-17-yl benzoate
- English name
- 11beta,17,21-trihydroxypregn-4-ene-3,20-dione 17-benzoate
- Molecular formula
- C28H34O6
- Molecular weight
- 466.56596
Names & synonyms
11β,17,21-trihydroxypregn-4-ene-3,20-dione 17-benzoate17-(Benzoyloxy)-11β,21-dihydroxypregn-4-ene-3,20-dione11beta,17,21-trihydroxypregn-4-ene-3,20-dione 17-benzoatePregn-4-ene-3,20-dione, 17-(benzoyloxy)-11,21-dihydroxy-, (11β)-
Database identifiers
- CAS
28956-89-0- PubChem CID
- 119845
- DTXSID
DTXSID10951574- ChEMBL
CHEMBL6029929- UNII
- BCV386QGUZ
- EC Number
- 249-328-8
- Nikkaji
- J286.490H
Properties
Physicochemical properties
- Melting point
- 177 · 177-178 °C
- Boiling point
- 638.5 · 638.5±55.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 12.98 · 12.98±0.10(Predicted)
- FDA UNII
- 386 QGUZ · BCV386QGUZ
Chemistry & industry
Suppliers5 total
上海杰股生物科技有限公司021-51698675 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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