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CHEBI:47564 - mometasone furoate

ChEBI IDCHEBI:47564
ChEBI Namemometasone furoate
Stars
Secondary ChEBI IDCHEBI:6971
Last Modified22 February 2017
DownloadsMolfile
FormulaC27H30Cl2O6
Net Charge0
Average Mass521.437
Monoisotopic Mass520.14194
SMILES[H][C@@]12C[C@@H](C)[C@](OC(=O)c3ccco3)(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C27H30Cl2O6/c1-15-11-19-18-7-6-16-12-17(30)8-9-24(16,2)26(18,29)21(31)13-25(19,3)27(15,22(32)14-28)35-23(33)20-5-4-10-34-20/h4-5,8-10,12,15,18-19,21,31H,6-7,11,13-14H2,1-3H3/t15-,18+,19+,21+,24+,25+,26+,27+/m1/s1
InChIKeyWOFMFGQZHJDGCX-ZULDAHANSA-N
Wikipedia
Roles Classification
Applications:
anti-inflammatory drug  A substance that reduces or suppresses inflammation.
anti-allergic agent  A drug used to treat allergic reactions.
ChEBI Ontology
Outgoing Relation(s)
mometasone furoate (CHEBI:47564) has functional parent mometasone (CHEBI:6970)
mometasone furoate (CHEBI:47564) has role anti-allergic agent (CHEBI:50857)
mometasone furoate (CHEBI:47564) has role anti-inflammatory drug (CHEBI:35472)
mometasone furoate (CHEBI:47564) is a 11β-hydroxy steroid (CHEBI:35346)
mometasone furoate (CHEBI:47564) is a 2-furoate ester (CHEBI:50856)
mometasone furoate (CHEBI:47564) is a 20-oxo steroid (CHEBI:36885)
mometasone furoate (CHEBI:47564) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
mometasone furoate (CHEBI:47564) is a organochlorine compound (CHEBI:36683)
mometasone furoate (CHEBI:47564) is a steroid ester (CHEBI:47880)
IUPAC Name 
9,21-dichloro-11β-hydroxy-16α-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate
Synonyms  Source
MOMETASONE FUROATEPDBeChem
mometasone 17-furoateChEBI
Manual XrefsDatabases
MOFPDBeChem
DB00764DrugBank
EP57401Patent
US4472393Patent
MometasoneWikipedia
D00690KEGG DRUG
1832DrugCentral
Registry NumbersSources
Beilstein:4340538Beilstein
CAS:83919-23-7ChemIDplus