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

General Information of Drug (ID: DR0716)
Drug Name
Fluorometholone
Synonyms
Flumetholon; Fluor-Op; Fluormetholon; Fluormetholone; Fluormetholonum; Fluoromethalone; Fluorometholon; Fluorometholonum; Fluorometholonum [INN-Latin]; Fluorometolona; Fluorometolona [INN-Spanish]; Fluorometolone [DCIT]; Neo-Oxylone; Cortilet; Delmeson; Efflumidex; FML Forte; FML Liquifilm; FML-S Liquifilm; Oxylone; Trilcin; U 8614; component of Neo-Oxylone; fluorometholone; 426-13-1; CHEBI:31625; EINECS 207-041-5; FML; NSC 33001; UNII-SV0CSG527L
Indication Chronic obstructive pulmonary disease [ICD11: CA22] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 376.5 Topological Polar Surface Area 74.6
Heavy Atom Count 27 Rotatable Bond Count 1
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5
Cross-matching ID
PubChem CID
9878
PubChem SID
91286 ; 220404 ; 855588 ; 7848430 ; 7979244 ; 8157129 ; 10321327 ; 11407278 ; 11466746 ; 11467866 ; 11486592 ; 14804353 ; 14902232 ; 24894996 ; 29228436 ; 46505984 ; 47572923 ; 47794581 ; 48393458 ; 48393459 ; 49698623 ; 50019438 ; 50103940 ; 50990491 ; 53786931 ; 56422125 ; 57325845 ; 71822899 ; 85788043 ; 87570182 ; 92125901 ; 92720066 ; 99368351 ; 103770583 ; 103913807 ; 104321775 ; 121363572 ; 124800816 ; 126620397 ; 134338309 ; 134973988 ; 135898484 ; 137008630 ; 144203991 ; 144212910 ; 152034527 ; 160963672 ; 162175073 ; 163835781 ; 170464629
ChEBI ID
ChEBI:31625
CAS Number
426-13-1
TTD Drug ID
D0P0HT
Formula
C22H29FO4
Canonical SMILES
CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)O
InChI
1S/C22H29FO4/c1-12-9-17-15-6-8-21(27,13(2)24)20(15,4)11-18(26)22(17,23)19(3)7-5-14(25)10-16(12)19/h5,7,10,12,15,17-18,26-27H,6,8-9,11H2,1-4H3/t12-,15-,17-,18-,19-,20-,21-,22-/m0/s1
InChIKey
FAOZLTXFLGPHNG-KNAQIMQKSA-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
6,7-dehydro-Fluorometholone DM006286 N. A. Unclear 1 [3]
6-hydroxy-Fluorometholone DM006288 N. A. Unclear 1 [3]
6,20-dehydroxy-Fluorometholone DM006289 N. A. Unclear 2 [3]
6,7-dehydro-20-hydroxy-Fluorometholone DM006287 N. A. Unclear 2 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR006744 Fluorometholone 6,7-dehydro-Fluorometholone Unclear Unclear [3]
MR006746 Fluorometholone 6-hydroxy-Fluorometholone Unclear Unclear [3]
MR006745 6,7-dehydro-Fluorometholone 6,7-dehydro-20-hydroxy-Fluorometholone Unclear Unclear [3]
MR006747 6-hydroxy-Fluorometholone 6,20-dehydroxy-Fluorometholone Unclear Unclear [3]
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 Fluorometholone 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 Gas chromatographic and mass spectral study of synthetic corticosteroid metabolism: fluorometholone

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