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

General Information of Drug (ID: DR2309)
Drug Name
Trihexyphenidyl
Synonyms
Trihexane; Trihexifenidilo; Trihexifenidilo [INN-Spanish]; Trihexy; Trihexylphenedyl; Trihexylphenidyl; Trihexylphenidyle; Trihexylphenizyl; Trihexyphenidyl (INN); Trihexyphenidyl [INN:BAN]; Trihexyphenidyle; Trihexyphenidyle [INN-French]; Trihexyphenidylum; Trihexyphenidylum [INN-Latin]; Triphenidyl; Apo-Trihex; Apo-Trihex (TN); Artane; Artane (TN); Artane Sequels; Benzhexol; Benzhexolum; PMS Trihexyphenidyl; Parkinane retard; SWR-0342SA; Sedrena (free base); trihexyphenidyl; 1-Piperidinepropanol, alpha-cyclohexyl-alpha-phenyl-; 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol; 144-11-6; BRN 0088959; EINECS 205-614-4; HSDB 3196; NSC 12268
Indication Parkinsonism [ICD11: 8A00] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 301.5 Topological Polar Surface Area 23.5
Heavy Atom Count 22 Rotatable Bond Count 5
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
5572
PubChem SID
9380 ; 76985 ; 5664292 ; 7978767 ; 8153428 ; 10508113 ; 11335547 ; 11360786 ; 11363526 ; 11366088 ; 11368650 ; 11372249 ; 11373976 ; 11376812 ; 11461758 ; 11466729 ; 11467849 ; 11484493 ; 11486538 ; 11488645 ; 11491190 ; 11492184 ; 11494446 ; 14751778 ; 29224611 ; 46507717 ; 47365113 ; 47515241 ; 47515242 ; 47662205 ; 47662206 ; 47662207 ; 47736399 ; 48110381 ; 48259153 ; 48416664 ; 49698895 ; 50016994 ; 50105266 ; 50483190 ; 57322850 ; 85209532 ; 85788388 ; 90341555 ; 96025321 ; 103555930 ; 104309620 ; 124750254 ; 124881579 ; 124881580
ChEBI ID
CHEBI:9720
CAS Number
144-11-6
TTD Drug ID
D09GFL
Formula
C20H31NO
Canonical SMILES
C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=CC=C3)O
InChI
1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2
InChIKey
HWHLPVGTWGOCJO-UHFFFAOYSA-N
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Unclear metabolic mechanism (DME-unclear) DME1256 Bacteroides sartorii Not Available Not Available [2]
Unclear metabolic mechanism (DME-unclear) DME1365 Bacteroides dorei Not Available Not Available [2]
Unclear metabolic mechanism (DME-unclear) DME1391 Bifidobacterium ruminatum Not Available Not Available [2]
Unclear metabolic mechanism (DME-unclear) DME1393 Blautia hansenii Not Available Not Available [2]
Unclear metabolic mechanism (DME-unclear) DME1402 Clostridium botulinum Not Available Not Available [2]
References
1 Trihexyphenidyl was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Mapping human microbiome drug metabolism by gut bacteria and their genes. Nature. 2019 Jun;570(7762):462-467.

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