Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR1107)
Drug Name
Mometasone furoate
Synonyms
Mometasone 17-furoate; Mometasone furoate; Asmanex; Asmanex Twisthaler; Danitin; Ecural; Elocone; Elomet; Flumeta; MOMETASONE FUROATE MONOHYDRATE; Nasonex; Nosorex; Rimelon; Sch 32088; Sch-32088; 04201GDN4R; 83919-23-7; 9,21-dichloro-11beta-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate; CHEBI:47564; CHEMBL1161; DSSTox_CID_3333; DSSTox_GSID_23333; DSSTox_RID_76981; UNII-04201GDN4R
Indication Allergy [ICD11: 4A80] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 521.4 Topological Polar Surface Area 93.8
Heavy Atom Count 35 Rotatable Bond Count 5
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6
Cross-matching ID
PubChem CID
441336
ChEBI ID
CHEBI:47564
CAS Number
83919-23-7
TTD Drug ID
D03HYX
Formula
C27H30Cl2O6
Canonical SMILES
CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CCl)OC(=O)C5=CC=CO5)C)O)Cl)C
InChI
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
InChIKey
WOFMFGQZHJDGCX-ZULDAHANSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11beta-oxidopregna-1,4-diene-3,20-dione 17-(2-furoate) DM004460 N. A. Oxidation - Epoxidation 1 [3]
6-beta-hydroxy-mometasone furoate DM004465
131769950
Oxidation - 6-beta-hydroxylation 1 [4]
9-alpha,21-beta-dichloro-11-beta,21-alpha-dihydroxy-16-alpha-methylpregna-1,4,17,20-tetraen-3-one 21-(2-furoate) DM004463 N. A. Other reaction - Rearrangement reaction 1 [5]
Mometasone DM004466
441335
Hydrolysis - Hydrolyzation 1 [4]
21-beta-chloro-21-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4,17,20-tetraen-3-one 21-(2-furoate DM004461 N. A. Other reaction - Rearrangement reaction 2 [6]
21-beta-chloro-21-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4,17,20-tetraen-3-one 21-(2-furoate) DM004464 N. A. Oxidation - Epoxidation 2 [5]
21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4-diene-3,20-dione DM004462 N. A. Hydrolysis - Hydrolyzation 2 [6]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR004789 Mometasone furoate 21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11beta-oxidopregna-1,4-diene-3,20-dione 17-(2-furoate) Oxidation - Epoxidation Unclear [3]
MR004792 Mometasone furoate 9-alpha,21-beta-dichloro-11-beta,21-alpha-dihydroxy-16-alpha-methylpregna-1,4,17,20-tetraen-3-one 21-(2-furoate) Other reaction - Rearrangement reaction Unclear [5]
MR004794 Mometasone furoate 6-beta-hydroxy-mometasone furoate Oxidation - 6-beta-hydroxylation Unclear [4]
MR004795 Mometasone furoate Mometasone Hydrolysis - Hydrolyzation Unclear [4]
MR004790 21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11beta-oxidopregna-1,4-diene-3,20-dione 17-(2-furoate) 21-beta-chloro-21-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4,17,20-tetraen-3-one 21-(2-furoate Other reaction - Rearrangement reaction Unclear [6]
MR004791 21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11beta-oxidopregna-1,4-diene-3,20-dione 17-(2-furoate) 21-chloro-17-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4-diene-3,20-dione Hydrolysis - Hydrolyzation Unclear [6]
MR004793 9-alpha,21-beta-dichloro-11-beta,21-alpha-dihydroxy-16-alpha-methylpregna-1,4,17,20-tetraen-3-one 21-(2-furoate) 21-beta-chloro-21-alpha-hydroxy-16-alpha-methyl-9-beta,11-beta-oxidopregna-1,4,17,20-tetraen-3-one 21-(2-furoate) Oxidation - Epoxidation Unclear [5]
⏷ Show the Full List of 7 MR(s)
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[2]
References
1 Posaconazole was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Regulation of drug-metabolizing cytochrome P450 enzymes by glucocorticoids. Drug Metab Rev. 2010 Nov;42(4):621-35.
3 #N/A
4 Mometasone furoate degradation and metabolism in human biological fluids and tissues
5 Liquid holding recovery of photodynamic damage in E. coli
6 DrugBank(Pharmacology-Metabolism):Mometasone furoate

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