Structure Info
- Chemspace ID
- CSCS06595020366 (Synthesis)
- IUPAC Name
- (1R,6R,13S)-13-hydroxy-16,17-dimethoxy-6-(prop-1-en-2-yl)-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3,8,10,14(19),15,17-hexaen-12-one
- Mol formula
- C23H22O7
- Mol weight
- 410 Da
- Catalog Number(s)
- M28011, T34394
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.73
- Heavy atoms count
- 30
- Rotatable bond count
- 3
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.347
- Polar surface area (Å)
- 83
- Hydrogen bond acceptors count
- 7
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS06595020366
Items Overall 1 item from 1 supplier
Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
---|---|---|---|---|---|---|
Molnova Chemicals | TBD | United States To: | 98 | 5 mg | 592 | |
Description: Rotenolone; CAS: 509-96-6 |
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