(-)-Afzelechin
Basic information
- CAS
19879-28-8- Standard SMILES
Oc1ccc([C@@H]2Oc3cc(O)cc(O)c3C[C@H]2O)cc1- InChIKey
RSYUFYQTACJFML-HIFRSBDPSA-N- Molecular formula
- C15H14O5
- Average molar mass
- 274.27 g/mol
- Monoisotopic mass
- 274.08412354
Overview
(-)-Afzelechin has been reported in Corymbia bleeseri, Corymbia dichromophloia, and other organisms with data available.
Names & identifiers
- Preferred name
- (-)-Afzelechin
- IUPAC
- (2S,3R)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
- English name
- (-)-Afzelechin
- Molecular formula
- C15H14O5
- Molecular weight
- 274.27
Names & synonyms
(-)-afzelechin19879-28-8Afzelechin, (-)-(2S,3R)-afzelechin5SEW76W5M7orb1941161SCHEMBL13002223HY-N123633,4',5,7-Flavantetrol, (-)-(2S,3R)-3,4-Dihydro-2-(4-hydroxyphenyl)-2H-1-benzopyran-3,5,7-triolDA-68930CS-0899030
Show more names
T83610(2S,3R)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol2H-1-Benzopyran-3,5,7-triol, 3,4-dihydro-2-(4-hydroxyphenyl)-, (2S,3R)-
Database identifiers
- CAS
19879-28-8- PubChem CID
- 44512487
- UNII
- 5SEW76W5M7
- Nikkaji
- J869.631D
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 328
Physicochemical properties
- Boiling point
- 583.4 · 583.4±50.0 °C(Predicted)
- Density
- 1.492 · 1.492±0.06 g/cm3(Predicted)
- pka
- 9 · 9+-.0.60(Predicted)
Chemistry & industry
Applications
Uses(-)-Afzelechin is a compound isolated from the rhizomes of Astilbe rivularis. (-)-Afzelechin shows poitent antioxidant activity[1].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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