Basic information
- CAS
122890-43-1- Standard SMILES
COc1cc2c(cc1O)C(=O)c1c(C)ccnc1-2- InChIKey
SQANFQYDLCUUNK-UHFFFAOYSA-N- Molecular formula
- C14H11NO3
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.07389321
Overview
isooncodine has been reported in Miliusa horsfieldii with data available.
Names & identifiers
- Preferred name
- 7-Hydroxy-8-methoxy-4-methyl-5H-indeno(1,2-b)pyridin-5-one
- IUPAC
- 7-hydroxy-8-methoxy-4-methylindeno[1,2-b]pyridin-5-one
- English name
- isooncodine
- Molecular formula
- C14H11NO3
- Molecular weight
- 241.24204
Names & synonyms
Isooncodine122890-43-1FJ5C9B526C7-hydroxy-8-methoxy-4-methylindeno[1,2-b]pyridin-5-one5H-Indeno(1,2-b)pyridin-5-one, 7-hydroxy-8-methoxy-4-methyl-7-hydroxy-8-methoxy-4-methylindeno(1,2-b)pyridin-5-one7-Hydroxy-8-methoxy-4-methyl-5H-indeno(1,2-b)pyridin-5-one7-Hydroxy-8-methoxy-4-methyl-5H-indeno[1,2-b]pyridin-5-one5H-Indeno[1,2-b]pyridin-5-one, 7-hydroxy-8-methoxy-4-methyl-RefChem:914332UNII-FJ5C9B526CCHEMBL465438
Show more names
orb2813850SCHEMBL279718658-methoxy-4-methyl-1H-indeno[1,2-b]pyridine-5,7-dioneDTXSID80924311TN8357Q15426259
Database identifiers
- CAS
122890-43-1- PubChem CID
- 129790
- DTXSID
DTXSID80924311- ChEMBL
CHEMBL465438- UNII
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Physicochemical properties
- FDA UNII
- 5 C9B526C · FJ5C9B526C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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