Basic information
- CAS
60142-17-8- Standard SMILES
COc1cccc2c(-c3ccc4c(c3O)C(C)NC(C)C4)c(C)cc(OC)c12- InChIKey
MXIZZLBQRBAZEX-UHFFFAOYSA-N- Molecular formula
- C24H27NO3
- Average molar mass
- 377.5 g/mol
- Monoisotopic mass
- 377.19909372
Overview
Dioncophyllin A has been reported in Triphyophyllum peltatum, Ancistrocladus abbreviatus, and Ancistrocladus barteri with data available.
Names & identifiers
- Preferred name
- Dioncophyllin A
- IUPAC
- 7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol
Names & synonyms
Dioncophyllin AMXIZZLBQRBAZEX-UHFFFAOYSA-N7-(4,5-Dimethoxy-2-methyl-1-naphthyl)-1,3-dimethyl-1,2,3,4-tetrahydro-8-isoquinolinol #8-Isoquinolinol, 7-(4,5-dimethoxy-2-methyl-1-naphthalenyl)-1,2,3,4-tetrahydro-1,3-dimethyl-, (1R,3R,7S)-8-Isoquinolinol, 7-(4,5-dimethoxy-2-methyl-1-naphthalenyl)-1,2,3,4-tetrahydro-1,3-dimethyl-, stereoisomer
Database identifiers
- CAS
60142-17-8- PubChem CID
- 3095
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 528
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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