2,11,12-trimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline
Basic information
- CAS
545-68-6- Standard SMILES
COc1cc2c(cc1OC)C13CC(OC)C=CC1=CCN3CC2- InChIKey
WXVSPYOOFCCEII-UHFFFAOYSA-N- Molecular formula
- C19H23NO3
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.1677936
Overview
AC1MRPWB has been reported in Erythrina fusca, Erythrina macrophylla, and other organisms with data available.
Names & identifiers
- Preferred name
- 2,11,12-trimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline
- IUPAC
- 2,11,12-trimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinoline
Names & synonyms
2,11,12-trimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolineAC1MRPWBDTXSID00392795CBA74043NS000946103,15,16-trimethoxy-1,2,6,7-tetradehydroerythrinanB0005-177886
Database identifiers
- CAS
545-68-6- PubChem CID
- 3472080
- DTXSID
DTXSID00392795- Nikkaji
- J3.388.624A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 517
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Related reactions
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Compound notes
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