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Structure

Pregna-1,4-diene-3,20-dione,11,17-dihydroxy-21-[(methylsulfonyl)oxy]-,(11b)-

CAS
35410-28-7
Catalog Number
ACM35410287
Category
Other Products
Molecular Weight
438.5344
Molecular Formula
C22H30O7S

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Specification

Synonyms
35410-28-7, STOCK1N-57457, CTK4H4480, MolPort-002-529-519, EINECS 252-549-2, ZINC08789270, AG-F-22527, MCULE-3534120062, 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-methanesulphonate, Pregna-1,4-diene-3,20-dione,11,17-dihydroxy-21-[(methylsulfonyl)oxy]-, (11b)-, Pregna-1,4-diene-3,20-dione,11b,17,21-trihydroxy-,21-methanesulfonate (6CI); Prednisolone 21-methanesulfonate
IUPAC Name
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] methanesulfonate
Canonical SMILES
CC12CC(C3C(C1CCC2(C(=O)COS(=O)(=O)C)O)CCC4=CC(=O)C=CC34C)O
InChI Key
TZEYKLAAPSZABE-CWNVBEKCSA-N
Density
1.37g/cm³
EC Number
252-549-2
Exact Mass
438.17100
H-Bond Acceptor
7
H-Bond Donor
2
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