General Information of Drug (ID: DR5229)
Drug Name
Dezocine
Synonyms SCHEMBL1369581; (5R,11S,13S)-13-amino-5-methyl-5,6,7,8,9,10,11,12-octahydro-5,11-methanobenzo[10]annulen-3-ol
Indication Pain [ICD11: MG30-MG3Z] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 245.36 Topological Polar Surface Area 46.2
Heavy Atom Count 18 Rotatable Bond Count 0
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
3033053
ChEBI ID
CHEBI:4474
CAS Number
53648-55-8
TTD Drug ID
D0P6VV
Formula
C16H23NO
Canonical SMILES
C[C@]12CCCCC[C@H]([C@@H]1N)CC3=C2C=C(C=C3)O
InChI
InChI=1S/C16H23NO/c1-16-8-4-2-3-5-12(15(16)17)9-11-6-7-13(18)10-14(11)16/h6-7,10,12,15,18H,2-5,8-9,17H2,1H3/t12-,15-,16+/m0/s1
InChIKey
VTMVHDZWSFQSQP-VBNZEHGJSA-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
M499 DM005005 N. A. Unclear - Unclear 1 [2]
M690 DM005004 N. A. Unclear - Unclear 1 [2]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR010829 Dezocine M690 Unclear - Unclear Unclear [2]
MR010830 Dezocine M499 Unclear - Unclear Unclear [2]
References
1 Natural products as sources of new drugs over the last 25 years. J Nat Prod. 2007 Mar;70(3):461-77.
2 Avapritinib: First Approval

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