Basic information
- CAS
40136-09-2- Standard SMILES
Cl.O=C1[C@@H]2C[C@@H](CN3CCCC[C@H]23)[C@@H]2CCCCN12- InChIKey
HXDWRMLLKZZVAQ-BHARVXRSSA-N- Molecular formula
- C15H25ClN2O
- Average molar mass
- 284.82 g/mol
- Monoisotopic mass
- 284.1655411
Names & identifiers
- Preferred name
- Oxysparteine hydrochloride
- IUPAC
- (1S,2S,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one;hydrochloride
Names & synonyms
Oxysparteine hydrochloride40136-09-2RefChem:109410417-Oxosparteine hydrochlorideaphylline hydrochlorideDTXSID809605727,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-6-one, dodecahydro-, monohydrochloride, (7R-(7-alpha,7a-alpha,14-alpha,14a-beta))-Spartein-10-one--hydrogen chloride (1/1)Spartein-17-one--hydrogen chloride (1/1)
Database identifiers
- CAS
40136-09-2- PubChem CID
- 218065
- DTXSID
DTXSID80960572
Properties
Computed structural properties
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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