(5beta,6beta,7beta,11alpha)-Matridin-15-one
Basic information
- Standard SMILES
O=C1CCC[C@H]2[C@@H]3CCCN4CCC[C@H](CN12)[C@H]34- InChIKey
ZSBXGIUJOOQZMP-UKTARXLSSA-N- Molecular formula
- C15H24N2O
- Average molar mass
- 248.36 g/mol
- Monoisotopic mass
- 248.18886339
Overview
(−)-matrine has been reported in Euchresta japonica and Gymnospermium alberti with data available.
Names & identifiers
- Preferred name
- (5beta,6beta,7beta,11alpha)-Matridin-15-one
- IUPAC
- (1S,2S,9R,17R)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one
Names & synonyms
(5beta,6beta,7beta,11alpha)-matridin-15-oneUPCMLD-DP048SCHEMBL177906UPCMLD-DP048:001ZSBXGIUJOOQZMP-UKTARXLSSA-NDTXSID901369404AKOS004119879AC-6057CCG-214815NCGC00161616-011H,5H,10H-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one, dodecahydro-, (7aR,13aS,13bS,13cR)-InChI=1/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-/m1/s
Database identifiers
- PubChem CID
- 638232
- DTXSID
DTXSID901369404- Nikkaji
- J3.808.179I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 356
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Related reactions
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Compound notes
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