(1R,2R,5S,6R,9R,12S,13R,19R)-6-[(2R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-2,19-dihydroxy-6,13-dimethyl-7-oxapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-15,17-diene-8,14-dione
Structure Info
- Chemspace ID
- CSSB21509663957 (In-Stock Building Blocks)
- IUPAC Name
- (1R,2R,5S,6R,9R,12S,13R,19R)-6-[(2R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-2,19-dihydroxy-6,13-dimethyl-7-oxapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-15,17-diene-8,14-dione
- Mol formula
- C28H34O7
- Mol weight
- 483 Da
- Catalog Number(s)
- Y4051981
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.91
- Heavy atoms count
- 35
- Rotatable bond count
- 1
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.678
- Polar surface area (Å)
- 110
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of (1R,2R,5S,6R,9R,12S,13R,19R)-6-[(2R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-2,19-dihydroxy-6,13-dimethyl-7-oxapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-15,17-diene-8,14-dione (C28H34O7) - CSSB21509663957](/st/structure/200/c64197d1ddd1edfdd0534c8133879305/CC1%253DC%2528C%2529C%2528%253DO%2529O%255BC%2540H%255D%2528C1%2529%255BC%2540%255D1%2528C%2529OC%2528%253DO%2529%255BC%2540%2540%255D23CC%255BC%2540H%255D4%255BC%2540%2540H%255D%2528C%255BC%2540%2540H%255D%2528O%2529C5%253DCC%253DCC%2528%253DO%2529%255BC%2540%255D45C%2529%255BC%2540%255D2%2528O%2529CC%255BC%2540H%255D13.png "C28H34O7")
- Zoom the structure
- CSSB21509663957
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| eNovation CN | 20 days | China To: | 97 | 5 mg | 1,265.00 | |
Description: Withaphysalin E; CAS: 118985-24-3 | ||||||
For a custom pack size or bulk
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