(1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
Structure Info
- Chemspace ID
- CSSB00161152448 (In-Stock Building Blocks)
- MFCD
- MFCD00871065, MFCD28347821
- IUPAC Name
- (1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol
- Mol formula
- C28H44O2
- Mol weight
- 413 Da
- Catalog Number(s)
- AA01E0NX, AG01E0QP, AKOS040744265, AR01E1FP, AX33561, BF33561, CS-M1343, CSC161152448, F987782, G60978, H995805, HY-76937, JH109628, LN01292067, MS-27134, OR1006894, T19370, Y3127984, Y6212433, ZXC289463
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.75
- Heavy atoms count
- 30
- Rotatable bond count
- 5
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.714
- Polar surface area (Å)
- 40
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 2
![Chemical structure of (1R,3R,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol (C28H44O2) - CSSB00161152448](/st/structure/200/09b217d4b9176aa7311712b0a4e2c813/CC%2528C%2529%255BC%2540%2540H%255D%2528C%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%2540%2540H%255D%2528O%2529C1%253DC.png "C28H44O2")
- Zoom the structure
- CSSB00161152448
Items Overall 6 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| ChemScene CN | 5 days | China To: | 97 | 10 mg | 2,400.00 | |
| ChemScene CN | 5 days | China To: | 97 | 25 mg | 4,080.00 | |
Description: Impurity of Doxercalciferol; CAS: 127516-23-8 | ||||||
| Fluorochem CN | 14 days | China To: | 97 | 10 mg | 2,865.00 | |
| Fluorochem CN | 14 days | China To: | 97 | 25 mg | 4,868.00 | |
Description: Impurity of Doxercalciferol; ; Storage Conditions: ambient storage; Hazard Codes: H302, H315, H319, H335; GHS Pictograms: GHS07; CAS: 127516-23-8 | ||||||
| eNovation CN | 20 days | China To: | 97 | 10 mg | 2,673.75 | |
| eNovation CN | 20 days | China To: | 97 | 25 mg | 4,548.25 | |
Description: Impurity of Doxercalciferol; CAS: 127516-23-8 | ||||||
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