Basic information
- Standard SMILES
C=C(C)[C@@H](O)[C@@H](O)c1c(OC)c(OC)cc2ccc(=O)oc12- InChIKey
USBKHQAQEKLUQV-KGLIPLIRSA-N- Molecular formula
- C16H18O6
- Average molar mass
- 306.31 g/mol
- Monoisotopic mass
- 306.1103383
Names & identifiers
- Preferred name
- 8-[(1S,2R)-1,2-dihydroxy-3-methylbut-3-enyl]-6,7-dimethoxychromen-2-one
- IUPAC
- 8-[(1S,2R)-1,2-dihydroxy-3-methylbut-3-enyl]-6,7-dimethoxychromen-2-one
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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