(1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
Structure Info
- Chemspace ID
- CSSB00134617767 (In-Stock Building Blocks)
- MFCD
- MFCD22124486
- IUPAC Name
- (1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
- Mol formula
- C27H44O3
- Mol weight
- 417 Da
- Catalog Number(s)
- 259604, AA00FBXA, AG00FC02, AH15194, AKOS030526871, AP15194, AR00FCP2, C144490, CD31001119, CS-0655318, CS-1176, CSC134617767, F84900, F987655, FC31506, HY-13292, MS-27264, T11643, Y1237638, Y6232795
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.35
- Heavy atoms count
- 30
- Rotatable bond count
- 6
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.777
- Polar surface area (Å)
- 61
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 3
![Chemical structure of (1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol (C27H44O3) - CSSB00134617767](/st/structure/200/45421317d0de3e9553679c5791586cb7/C%255BC%2540H%255D%2528CCCC%2528C%2529%2528C%2529O%2529%255BC%2540H%255D1CC%255BC%2540H%255D2%255CC%2528CCC%255BC%2540%255D12C%2529%253DC%255CC%253DC1%255CC%255BC%2540%2540H%255D%2528O%2529C%255BC%2540%2540H%255D%2528O%2529C1%253DC.png "C27H44O3")
- Zoom the structure
- CSSB00134617767
Items Overall 9 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| ChemScene CN | 5 days | China To: | 98 | 1 mg | 960.00 | |
| ChemScene CN | 5 days | China To: | 98 | 5 mg | 3,000.00 | |
| ChemScene CN | 5 days | China To: | 98 | 10 mg | 3,828.00 | |
Description: Impurity B of Calcitriol; CAS: 66791-71-7 | ||||||
| Fluorochem CN | 14 days | China To: | 98 | 1 mg | 1,171.00 | |
| Fluorochem CN | 14 days | China To: | 98 | 5 mg | 3,580.00 | |
| Fluorochem CN | 14 days | China To: | 98 | 10 mg | 4,567.00 | |
Description: Impurity B of Calcitriol; ; Storage Conditions: ambient storage; Hazard Codes: H302, H315, H319, H335; GHS Pictograms: GHS07; CAS: 66791-71-7 | ||||||
| eNovation CN | 20 days | China To: | 98 | 1 mg | 1,069.50 | |
| eNovation CN | 20 days | China To: | 98 | 5 mg | 3,340.75 | |
| eNovation CN | 20 days | China To: | 98 | 10 mg | 4,266.50 | |
Description: Impurity B of Calcitriol; CAS: 66791-71-7 | ||||||
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