Basic information
- Standard SMILES
C=CC1C2=CCOC(=O)C2=COC1OC1OC(CO)C(O)C(O)C1O- InChIKey
DUAGQYUORDTXOR-UHFFFAOYSA-N- Molecular formula
- C16H20O9
- Average molar mass
- 356.32 g/mol
- Monoisotopic mass
- 356.11073221
Names & identifiers
- Preferred name
- 5-ethenyl-1-oxo-5,6-dihydro-1H,3H-pyrano[3,4-c]pyran-6-yl hexopyranoside
- IUPAC
- 4-ethenyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,6-dihydro-3H-pyrano[3,4-c]pyran-8-one
Names & synonyms
3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4-vinyl-4,6-dihydro-3H-pyrano[3,4-c]pyran-8-oneDTXSID30871987s37775-ethenyl-1-oxo-5,6-dihydro-1H,3H-pyrano[3,4-c]pyran-6-yl hexopyranosideDB-045402
Database identifiers
- PubChem CID
- 354445
- DTXSID
DTXSID30871987
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 598
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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