4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-
Basic information
- CAS
72021-22-8- Standard SMILES
C[C@@H]1O[C@@H](Oc2coc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O- InChIKey
XCVOCJFOQNDTNC-ZNDRGHTASA-N- Molecular formula
- C15H16O9
- Average molar mass
- 340.28 g/mol
- Monoisotopic mass
- 340.07943208
Overview
Eucryphin has been reported in Durio zibethinus, Hymenaea martiana, and other organisms with data available.
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-
- IUPAC
- 5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
Names & synonyms
72021-22-8TufulingosideSmiglanineurryphinCHEMBL470337DTXSID009927144H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-5,7-dihydroxy-5,7-Dihydroxy-4-oxo-4H-1-benzopyran-3-yl 6-deoxyhexopyranoside5,7-Dihydroxy-4-oxo-4H-1-benzopyran-3-yl 6-deoxy-alpha-L-mannopyranoside
Database identifiers
- CAS
72021-22-8- PubChem CID
- 5488575
- DTXSID
DTXSID00992714- ChEMBL
CHEMBL470337- Nikkaji
- J744.920H
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 521
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Related reactions
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Compound notes
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