9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate
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9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate
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CAS No:
50733-54-5
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Formula:
C23H31BrO6
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Chemical Name:
9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate
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Synonyms:
SCHEMBL9277542;9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione21-acetate;ACN-053276;[2-[(8S,9R,10S,11S,13S,14S,17R)-9-bromo-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
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CAS No:
9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate Basic Attributes
483.4
482.1304
DTXSID30722122
9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate Use and Manufacturing
11α, 17α, 21-trihydroxypregna-4-ene-3, 20-dione (ie epihydrocortisone) can be acetylated (21-hydroxyl), (11-hydroxyl) sulfonylated and combined Eliminate the formation of 9(11)-double bond, [9(11)-double bond and hypobromous acid] addition to prepare the product.
Intermediate of fludrocortisone acetate.
Computed Properties
Molecular Weight:483.4
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:482.13040
Monoisotopic Mass:482.13040
Topological Polar Surface Area:101
Heavy Atom Count:30
Complexity:838
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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9-Bromo-11,17,21-trihydroxypregn-4-ene-3,20-dione 21-acetate
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