Structure Info
- Chemspace ID
- CSSS06256040498 (In-Stock Screening Compounds)
- IUPAC Name
- (1R,3R,5S,8S,9R,12S,13R)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1⁹,¹².0³,⁵.0⁵,¹³]tetradecane-6,11-dione
- Mol formula
- C15H18O7
- Mol weight
- 310 Da
- Catalog Number(s)
- ArZ-UP481655, CFN91713, ZX-CY003431
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -1.08
- Heavy atoms count
- 22
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.866
- Polar surface area (Å)
- 106
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSS06256040498
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