alpha-Coralydine
Basic information
- CAS
7058-95-9- Standard SMILES
COc1cc2c(cc1OC)C(C)N1CCc3cc(OC)c(OC)cc3C1C2- InChIKey
ZAODQVCWAXRSRG-UHFFFAOYSA-N- Molecular formula
- C22H27NO4
- Average molar mass
- 369.5 g/mol
- Monoisotopic mass
- 369.19400834
Names & identifiers
- Preferred name
- alpha-Coralydine
- IUPAC
- 2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Names & synonyms
alpha-CoralydineNSC 975997058-95-92,3,10,11-Tetramethoxy-8-methyl-5,8,13,13a-tetrahydro-6H-isoquino(3,2-a)isoquinoline.alpha.-CoralydineNSC975992,3,10,11-Tetramethoxy-8-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline2,3,10,11-tetramethoxy-8-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline2,3,10,11-tetramethoxy-8-methyl-5,8,13,13a-tetrahydro-6h-isoquino[3,2-a] isoquinoline
Database identifiers
- CAS
7058-95-9- PubChem CID
- 428666
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 40.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 503
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Related reactions
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Compound notes
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