Basic information
- CAS
55743-09-4- Standard SMILES
Cc1c(O)c(C=O)c2c(c1O)C(=O)C[C@@H](c1ccccc1)O2- InChIKey
ONESXBRHUWVWFD-ZDUSSCGKSA-N- Molecular formula
- C17H14O5
- Average molar mass
- 298.29 g/mol
- Monoisotopic mass
- 298.08412354
Overview
Lawinal has been reported in Desmos and Syzygium nervosum with data available.
Names & identifiers
- Preferred name
- Lawinal
- IUPAC
- (2S)-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-2,3-dihydrochromene-8-carbaldehyde
- English name
- lawinal
- Molecular formula
- C17H14O5
- Molecular weight
- 298.29
Names & synonyms
Lawinal55743-09-4(2S)-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-2,3-dihydrochromene-8-carbaldehyde2H-1-Benzopyran-8-carboxaldehyde, 3,4-dihydro-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-, (S)-RefChem:9245725,7-dihydroxy-8-methyl-4-oxo-2-phenyl-2,3-dihydrochromene-6-carbaldehydeCHEMBL53664DTXSID90971119(2S)-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-8-carbaldehyde(2S)-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-chromane-8-carbaldehyde2H-1-Benzopyran-8-carboxaldehyde, 3,4-dihydro-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-, (2S)-(2S)-8-formyl-5,7-dihydroxy-6-methylflavanone
Database identifiers
- CAS
55743-09-4- PubChem CID
- 189152
- DTXSID
DTXSID90971119- ChEMBL
CHEMBL53664- Nikkaji
- J2.016.702E
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 431
Chemistry & industry
Applications
DescriptionLawinal is a flavonoid derived from Desmos cochinchinensis Lous that has been shown to have anti-HIV activity.
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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