Basic information
- CAS
73590-03-1- Standard SMILES
COc1cc(OC)c2c(c1O)C(=O)c1cc(C)ncc1C2=O- InChIKey
IVBXHDBKVLRPEJ-UHFFFAOYSA-N- Molecular formula
- C16H13NO5
- Average molar mass
- 299.28 g/mol
- Monoisotopic mass
- 299.07937252
Overview
8-O-methylbostrycoidin is a member of isoquinolines.
Names & identifiers
- Preferred name
- 6-Hydroxy-7,9-dimethoxy-3-methylbenzo[g]isoquinoline-5,10-dione
- IUPAC
- 6-hydroxy-7,9-dimethoxy-3-methylbenzo[g]isoquinoline-5,10-dione
Names & synonyms
8-O-methylbostrycoidin6-hydroxy-7,9-dimethoxy-3-methylbenzo[g]isoquinoline-5,10-dione73590-03-1RLE38WJL34UNII-RLE38WJL34CHEMBL1163695SCHEMBL31536856DTXSID50223782CHEBI:206030Benz(])soquinoline-5,10-dione, 6-hydroxy-7,9-dimethoxy-3-methyl-Benz[(])soquinoline-5,10-dione, 6-hydroxy-7,9-dimethoxy-3-methyl-6-HYDROXY-7,9-DIMETHOXY-3-METHYLBENZ(G)ISOQUINOLINE-5,10-DIONE
Show more names
BENZ(G)ISOQUINOLINE-5,10-DIONE, 6-HYDROXY-7,9-DIMETHOXY-3-METHYL-
Database identifiers
- CAS
73590-03-1- PubChem CID
- 188136
- DTXSID
DTXSID50223782- ChEMBL
CHEMBL1163695- ChEBI
CHEBI:206030- UNII
- RLE38WJL34
- Nikkaji
- J1.072.482A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 85.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 467
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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