CHEBI:31184 - alclometasone dipropionate

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ChEBI Name alclometasone dipropionate
ChEBI ID CHEBI:31184
Definition A prednisolone compound having an α-chloro substituent at the 7-position, an α-methyl substituent at the 16-position and O-propanoyl groups at the 17- and 21-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H37ClO7
Net Charge 0
Average Mass 521.04200
Monoisotopic Mass 520.22278
InChI InChI=1S/C28H37ClO7/c1-6-22(33)35-14-21(32)28(36-23(34)7-2)15(3)10-18-24-19(29)12-16-11-17(30)8-9-26(16,4)25(24)20(31)13-27(18,28)5/h8-9,11,15,18-20,24-25,31H,6-7,10,12-14H2,1-5H3/t15-,18+,19-,20+,24-,25+,26+,27+,28+/m1/s1
InChIKey DJHCCTTVDRAMEH-DUUJBDRPSA-N
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([H])[C@@]2([H])[C@H](Cl)CC2=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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing alclometasone dipropionate (CHEBI:31184) has functional parent prednisolone (CHEBI:8378)
alclometasone dipropionate (CHEBI:31184) has role anti-inflammatory drug (CHEBI:35472)
alclometasone dipropionate (CHEBI:31184) is a 11β-hydroxy steroid (CHEBI:35346)
alclometasone dipropionate (CHEBI:31184) is a 20-oxo steroid (CHEBI:36885)
alclometasone dipropionate (CHEBI:31184) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
alclometasone dipropionate (CHEBI:31184) is a chlorinated steroid (CHEBI:77175)
alclometasone dipropionate (CHEBI:31184) is a glucocorticoid (CHEBI:24261)
alclometasone dipropionate (CHEBI:31184) is a propanoate ester (CHEBI:36243)
alclometasone dipropionate (CHEBI:31184) is a steroid ester (CHEBI:47880)
IUPAC Name
(7α,11β,16α)-7-chloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate
Synonym Source
Alclometasone dipropionate KEGG DRUG
Manual Xrefs Databases
4493 DrugCentral
D01820 KEGG DRUG
DB00240 DrugBank
View more database links
Registry Numbers Types Sources
6493669 Beilstein Registry Number Beilstein
66734-13-2 CAS Registry Number ChemIDplus
66734-13-2 CAS Registry Number DrugBank
66734-13-2 CAS Registry Number KEGG DRUG
Last Modified
22 February 2017