CHEBI:31620 - flumethasone pivalate

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ChEBI Name flumethasone pivalate
ChEBI ID CHEBI:31620
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H36F2O6
Net Charge 0
Average Mass 494.56795
Monoisotopic Mass 494.24800
InChI InChI=1S/C27H36F2O6/c1-14-9-16-17-11-19(28)18-10-15(30)7-8-24(18,5)26(17,29)20(31)12-25(16,6)27(14,34)21(32)13-35-22(33)23(2,3)4/h7-8,10,14,16-17,19-20,31,34H,9,11-13H2,1-6H3/t14-,16+,17+,19+,20+,24+,25+,26+,27+/m1/s1
InChIKey JWRMHDSINXPDHB-OJAGFMMFSA-N
SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)COC(=O)C(C)(C)C)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@]12C
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
Application(s): anti-inflammatory drug
A substance that reduces or suppresses inflammation.
antipruritic drug
A drug, usually applied topically, that relieves pruritus (itching).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing flumethasone pivalate (CHEBI:31620) has functional parent flumethasone (CHEBI:34764)
flumethasone pivalate (CHEBI:31620) has role anti-inflammatory drug (CHEBI:35472)
flumethasone pivalate (CHEBI:31620) has role antipruritic drug (CHEBI:59683)
flumethasone pivalate (CHEBI:31620) is a 11β-hydroxy steroid (CHEBI:35346)
flumethasone pivalate (CHEBI:31620) is a 17α-hydroxy steroid (CHEBI:35342)
flumethasone pivalate (CHEBI:31620) is a 20-oxo steroid (CHEBI:36885)
flumethasone pivalate (CHEBI:31620) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
flumethasone pivalate (CHEBI:31620) is a fluorinated steroid (CHEBI:50830)
flumethasone pivalate (CHEBI:31620) is a glucocorticoid (CHEBI:24261)
flumethasone pivalate (CHEBI:31620) is a pivalate ester (CHEBI:50784)
flumethasone pivalate (CHEBI:31620) is a tertiary α-hydroxy ketone (CHEBI:139592)
IUPAC Name
6α,9-difluoro-11β,17-dihydroxy-16α-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate
Synonym Source
Flumetasone pivalate KEGG DRUG
Manual Xrefs Databases
1198 DrugCentral
D01464 KEGG DRUG
DB00663 DrugBank
View more database links
Registry Number Type Source
2002-29-1 CAS Registry Number ChemIDplus
Last Modified
07 February 2018