CHEBI:31276 - betamethasone dipropionate

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ChEBI Name betamethasone dipropionate
Definition A steroid ester that is betamethasone in which the hydroxy hydrogens at positions 17 and 21 are replaced by propanoyl groups. It is used in combination with calcipotriene hydrate, a synthetic vitamin D analogue, for the topical treatment of plaque psoriasis in adult patients.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C28H37FO7
Net Charge 0
Average Mass 504.58758
Monoisotopic Mass 504.25233
InChI InChI=1S/C28H37FO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1
SMILES [H][C@@]12C[C@H](C)[C@](OC(=O)CC)(C(=O)COC(=O)CC)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C
Roles Classification
Application(s): antipsoriatic
A drug used to treat psoriasis.
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ChEBI Ontology
Outgoing betamethasone dipropionate (CHEBI:31276) has functional parent betamethasone (CHEBI:3077)
betamethasone dipropionate (CHEBI:31276) has role antipsoriatic (CHEBI:50748)
betamethasone dipropionate (CHEBI:31276) is a 11β-hydroxy steroid (CHEBI:35346)
betamethasone dipropionate (CHEBI:31276) is a 20-oxo steroid (CHEBI:36885)
betamethasone dipropionate (CHEBI:31276) is a 3-oxo-Δ14-steroid (CHEBI:77166)
betamethasone dipropionate (CHEBI:31276) is a fluorinated steroid (CHEBI:50830)
betamethasone dipropionate (CHEBI:31276) is a propanoate ester (CHEBI:36243)
betamethasone dipropionate (CHEBI:31276) is a steroid ester (CHEBI:47880)
Incoming Enstilar (CHEBI:90855) has part betamethasone dipropionate (CHEBI:31276)
9-fluoro-11β-hydroxy-16β-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate
Synonyms Sources
9-Fluoro-11β,17,21-trihydroxy-16β-methylpregna-1,4-diene-3,20-dione-17,21-dipropionate ChemIDplus
Betamethasone 17,21-dipropionate ChemIDplus
Manual Xrefs Databases
353 DrugCentral
Betamethasone_Dipropionate Wikipedia
DB00443 DrugBank
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Registry Numbers Types Sources
3638108 Reaxys Registry Number Reaxys
3638108 Beilstein Registry Number Beilstein
5593-20-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
22 February 2017