Structure Info
- Chemspace ID
- CSSS00159261601 (In-Stock Screening Compounds)
- MFCD
- MFCD20260991
- IUPAC Name
- (3R)-2,5-dihydroxy-7-methoxy-2,4-dihydro-9',11'-dioxaspiro[1-benzopyran-3,4'-tricyclo[6.3.0.0³,⁶]undecane]-1'(8'),2',6'-trien-4-one
- Mol formula
- C18H14O7
- Mol weight
- 342 Da
- Catalog Number(s)
- AG00DGXE, ArZ-UP486638, BBP01607, CD32001125, CFN98844, CSC159261601, FS-9961, JH322040, LN04628632, TN2765, Y3318316, ZX-CY008414
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.6
- Heavy atoms count
- 25
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.277
- Polar surface area (Å)
- 94
- Hydrogen bond acceptors count
- 7
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSS00159261601
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