Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC(=O)OCC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3=CCC21C- InChIKey
YUWPMEXLKGOSBF-UHFFFAOYSA-N- Molecular formula
- C23H30O5
- Average molar mass
- 386.5 g/mol
- Monoisotopic mass
- 386.20932405
Names & identifiers
- Preferred name
- Prednisolone, 1,2-dihydro-9,11-dedihydro-11-desoxy-, 21-acetate(ester)
- IUPAC
- [2-(17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Names & synonyms
17-Hydroxy-3,20-dioxopregna-4,9(11)-dien-21-yl acetate #YUWPMEXLKGOSBF-UHFFFAOYSA-NPrednisolone, 1,2-dihydro-9,11-dedihydro-11-desoxy-, 21-acetate(ester)
Database identifiers
- PubChem CID
- 536715
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 808
Related reactions
5 records
Compound notes
Loading…