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

General Information of Drug (ID: DR1239)
Drug Name
Paramethadione
Synonyms
Paradione; Paradione (TN); Parametadiona; Parametadiona [INN-Spanish]; Parametadione; Parametadione [DCIT]; Paramethadione [BAN:INN]; Paramethadionum; Paramethadionum [INN-Latin]; Isoethadione; PARAMETHADIONE; 115-67-3; 2,4-Oxazolidinedione, 5-ethyl-3,5-dimethyl-; 3,5-Dimethyl-5-ethyloxazolidine-2,4-dione; 5-Ethyl-3,5-dimethyl-1,3-oxazolidine-2,4-dione; 5-Ethyl-3,5-dimethyl-2,4-oxazolidinedione; 5-Ethyl-3,5-dimethyloxazolidine-2,4-dione; A 348; BRN 0127715; C7H11NO3; CHEBI:7921; EINECS 204-098-8; HSDB 3245
Indication Embryofetopathy [ICD11: LD2F] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 157.17 Topological Polar Surface Area 46.6
Heavy Atom Count 11 Rotatable Bond Count 1
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
8280
PubChem SID
9615 ; 7784768 ; 7847561 ; 8155802 ; 10504554 ; 15170974 ; 29226988 ; 46509173 ; 48416379 ; 50001336 ; 51133638 ; 57324899 ; 103304186 ; 104317402 ; 121362245 ; 124894455 ; 126666661 ; 127339772 ; 127339773 ; 127339774 ; 127339775 ; 132522418 ; 134224198 ; 134338502 ; 134975033 ; 135374153 ; 135904528 ; 137101269 ; 139640761 ; 142319575 ; 144076322 ; 160963962 ; 163263663 ; 175611118 ; 176262004 ; 177513112 ; 178103835 ; 179225306 ; 223440591 ; 223655529 ; 226421236 ; 249907748
ChEBI ID
CHEBI:7921
CAS Number
115-67-3
TTD Drug ID
D09JBP
Formula
C7H11NO3
Canonical SMILES
CCC1(C(=O)N(C(=O)O1)C)C
InChI
1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3
InChIKey
VQASKUSHBVDKGU-UHFFFAOYSA-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
5-Ethyl-5-methyl-1,3-oxazolidine-2,4-dione DM001175
232592
Oxidation - N-Demethylation 1 [2] , [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR002868 Paramethadione 5-Ethyl-5-methyl-1,3-oxazolidine-2,4-dione Oxidation - N-Demethylation CYP2C9 [2], [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 2C9 (CYP2C9) DME0019 Homo sapiens
CP2C9_HUMAN
1.14.14.1
[2]
References
1 Paramethadione was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 PubChem:Paramethadione
3 Paramethadione and metabolite serum levels in humans after a single oral paramethadione dose J Pharm Sci. 1975 Oct;64(10):1702-3. doi: 10.1002/jps.2600641027.

If you find any error in data or bug in web service, please kindly report it to Dr. Yin and Dr. Li.