Structure Info
- Chemspace ID
- CSSS00016990094 (In-Stock Screening Compounds)
- MFCD
- MFCD20260635
- IUPAC Name
- methyl 2-hydroxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoate
- Mol formula
- C14H18O9
- Mol weight
- 330 Da
- Catalog Number(s)
- 108124-75-0, 160262, A119001806, AA008Y6F, ACM108124750, AG008Y97, AG106269, AR008YY7, ArZ-UP486880, BBP00782, BD235743, CD32002890, CFN99087, CSC016990094, FS-10119, LN03247930, NP4775, TN3155, W1964, Y3234448, ZX-CY008656
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.25
- Heavy atoms count
- 23
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 146
- Hydrogen bond acceptors count
- 8
- Hydrogen bond donors count
- 5
- Zoom the structure
- CSSS00016990094
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