Propan-2-yl (3R,4E,6R)-6-[(1R,3aS,4E,7aR)-4-{2-[(1Z,3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethylhept-4-enoate
Structure Info
- Chemspace ID
- CSSB00102520388 (In-Stock Building Blocks)
- MFCD
- MFCD12911891
- IUPAC Name
- propan-2-yl (3R,4E,6R)-6-[(1R,3aS,4E,7aR)-4-{2-[(1Z,3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethylhept-4-enoate
- Mol formula
- C31H48O5
- Mol weight
- 501 Da
- Catalog Number(s)
- 156965-06-9, 84945, AA00ABY9, ACM156965069, AE81949, AKOS025312294, CSC102520388, H63264, HY-32347, JH160086, LN01346834, T446790, TX00AD6P, TYD-05381, Y6126385
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.8
- Heavy atoms count
- 36
- Rotatable bond count
- 8
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.709
- Polar surface area (Å)
- 87
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 3
![Chemical structure of Propan-2-yl (3R,4E,6R)-6-[(1R,3aS,4E,7aR)-4-{2-[(1Z,3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]-3-hydroxy-2,2-dimethylhept-4-enoate (C31H48O5) - CSSB00102520388](/st/structure/200/1766d3272f16baebd7876cd3975630d9/CC%2528C%2529OC%2528%253DO%2529C%2528C%2529%2528C%2529%255BC%2540H%255D%2528O%2529%255CC%253DC%255C%255BC%2540%2540H%255D%2528C%2529%255BC%2540H%255D1CC%255BC%2540H%255D2%255CC%2528CCC%255BC%2540%255D12C%2529%253DC%255CC%253DC1%255CC%255BC%2540%2540H%255D%2528O%2529C%255BC%2540H%255D%2528O%2529C1%253DC.png "C31H48O5")
- Zoom the structure
- CSSB00102520388
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| A2B Chem | 12 days | United States To: | 95 | 5 mg | 2,470.20 | |
Description: Tisocalcitate; CAS: 156965-06-9 | ||||||
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