Braylin
Basic information
- Standard SMILES
COc1cc2ccc(=O)oc2c2c1OC(C)(C)C=C2- InChIKey
UOFNVZWWIXXTMZ-UHFFFAOYSA-N- Molecular formula
- C15H14O4
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.08920892
Overview
6-methoxy-8,8-dimethylpyrano[2,3-h]chromen-2-one has been reported in Cedrelopsis grevei, Geleznowia verrucosa, and other organisms with data available.
Names & identifiers
- Preferred name
- Braylin
- IUPAC
- 6-methoxy-8,8-dimethylpyrano[2,3-f]chromen-2-one
Names & synonyms
Braylin6054-10-06-methoxy-8,8-dimethylpyrano[2,3-f]chromen-2-one6-methoxy-8,8-dimethylpyrano(2,3-f)chromen-2-oneRefChem:917532CHEMBL5292106-Methoxy-8,8-dimethyl-2H,8H-pyrano[2,3-f]chromen-2-oneBrayelin2H, 8H-Benzo[1,2-b2H-1-Benzopyran-6-acrylic acid, 5-hydroxy-8-methoxy-2,2-dimethyl-, delta-lactone2H,8H-Benzo[1,2-b:3,4-b']dipyran-2-one,6-methoxy-8,8-dimethyl-orb1683046
Show more names
SCHEMBL30589491UOFNVZWWIXXTMZ-UHFFFAOYSA-NDTXSID601370054GAA05410HY-N2958BDBM50008737TN3537AKOS032948526
Database identifiers
- PubChem CID
- 618370
- DTXSID
DTXSID601370054- ChEMBL
CHEMBL529210- Nikkaji
- J13.235G
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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