(3R,11bR)-9,10-dimethoxy-3-isobutyl-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-one
CHEBI:CHEBI_64029
Definition
A 9,10-dimethoxy-3-isobutyl-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-one in which both stereocentres have R configuration.
Chemical Information
- Molecular Formula
- C19H27NO3
- Molecular Mass
- 317.42260
- Charge
- 0
- SMILES
- [H][C@@]1(CC(C)C)CN2CCc3cc(OC)c(OC)cc3[C@@]2([H])CC1=O
- InChI
- InChI=1S/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16-/m1/s1
- InChIKey
- MKJIEFSOBYUXJB-GDBMZVCRSA-N
Alternative Names
- (+)-Ro 1-9569
- (+)-tetrabenazine
- (3R,11bR)-3-isobutyl-9,10-dimethoxy-3,4,6,7-tetrahydro-1H-pyrido[2,1-a]isoquinolin-2(11bH)-one
- (3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-one
- (R,R)-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2H-benzo[a]quinolizin-2-one
Drug Classification
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- core#notation
- CHEBI:64029
- oboInOwl#hasDbXref
- Reaxys:18336520
Additional References
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Additional Attributes
- oboInOwl#hasOBONamespace
- chebi_ontology
- oboInOwl#id
- CHEBI:64029
- core#notation
- CHEBI:64029
- oboInOwl#hasDbXref
- Reaxys:18336520
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- chebi#is_enantiomer_of
- http://purl.obolibrary.org/obo/CHEBI_64030
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- BFO_0000051
- http://purl.obolibrary.org/obo/CHEBI_9467
- owl#annotatedSource
- t266440
- owl#someValuesFrom
- t320058