Basic information
- Standard SMILES
CC(=O)OC[C@H]1O[C@@H](n2cc(C=O)c3c(F)cccc32)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
QIKHCMDHYRFVRL-DODNOZFWSA-N- Molecular formula
- C23H24FNO10
- Average molar mass
- 493.4 g/mol
Names & identifiers
- Preferred name
- 4-fluoro-1-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)indole-3-carboxaldehyde
- IUPAC
- [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(4-fluoro-3-formylindol-1-yl)oxan-2-yl]methyl acetate
Names & synonyms
SCHEMBL1405579QIKHCMDHYRFVRL-DODNOZFWSA-N4-fluoro-1-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)indole-3-carboxaldehyde(2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(4-fluoro-3-formyl-1H-indol-1-yl)tetrahydro-2H-pyran-3,4,5-triyl triacetate
Database identifiers
- PubChem CID
- 71500259
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 837
Related reactions
4 records
Compound notes
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