Structure Info
- Chemspace ID
- CSSS00137409809 (In-Stock Screening Compounds)
- MFCD
- MFCD26406148
- IUPAC Name
- 1-(2,6-dihydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethan-1-one
- Mol formula
- C14H18O9
- Mol weight
- 330 Da
- Catalog Number(s)
- AA00DJZA, AG00DK22, ArZ-UP484070, BBP02934, BD298305, CD32001218, CFN96153, CSC137409809, FS-8712, HY-N3081, LN04627989, TN4766, X217651, Y3313751, ZX-CY005846
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.35
- Heavy atoms count
- 23
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 157
- Hydrogen bond acceptors count
- 9
- Hydrogen bond donors count
- 6
- Zoom the structure
- CSSS00137409809
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