Basic information
- CAS
101832-31-9- Standard SMILES
COc1cc2c3c(c1OC)-c1c(ccc(O)c1OC)C[C@@H]3[NH+](CCN1CCOCC1)CC2.[Cl-]- InChIKey
CCNMYQDGVXUNTL-FERBBOLQSA-N- Molecular formula
- C25H33ClN2O5
- Average molar mass
- 477 g/mol
- Monoisotopic mass
- 476.2077999
Names & identifiers
- Preferred name
- 6a-alpha-Noraporphin-9-ol, 6-(2-morpholinoethyl)-1,2,10-trimethoxy-, monohydrochloride
- IUPAC
- (6aS)-1,2,11-trimethoxy-6-(2-morpholin-4-ylethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride
Names & synonyms
6a-alpha-Noraporphin-9-ol, 6-(2-morpholinoethyl)-1,2,10-trimethoxy-, monohydrochloride6-(2-Morpholinoethyl)-1,2,10-trimethoxy-6a-alpha-noraporphin-9-ol monohydrochloride101832-31-9RefChem:309450
Database identifiers
- CAS
101832-31-9- PubChem CID
- 58993
Properties
Computed structural properties
- Topological polar surface area
- 64.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 617
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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