(1S,4aR,5R,7S,7aS)-7-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-5-yl 4-hydroxy-3,5-dimethoxybenzoate
Structure Info
- Chemspace ID
- CSSB00159261380 (In-Stock Building Blocks)
- MFCD
- MFCD20274712
- IUPAC Name
- (1S,4aR,5R,7S,7aS)-7-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-5-yl 4-hydroxy-3,5-dimethoxybenzoate
- Mol formula
- C24H32O13
- Mol weight
- 529 Da
- Catalog Number(s)
- AA00AKT2, ACM144049729-1, AE93426, AG00AKVU, AKOS032962435, AR00ALKU, ArZ-UP487276, BBP01946, BUP20755, CD32002422, CFN99483, CSC159261380, FS-10360, H63016, HY-N2728, LN04608299, NP3794, ST00AMCM, TN3191, TX00AM1I, ZX-CY009052
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.98
- Heavy atoms count
- 37
- Rotatable bond count
- 8
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.625
- Polar surface area (Å)
- 194
- Hydrogen bond acceptors count
- 12
- Hydrogen bond donors count
- 6
![Chemical structure of (1S,4aR,5R,7S,7aS)-7-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-5-yl 4-hydroxy-3,5-dimethoxybenzoate (C24H32O13) - CSSB00159261380](/st/structure/200/5154f2dd838eb62825d9b1fcf0d5a567/COC1%253DCC%2528%253DCC%2528OC%2529%253DC1O%2529C%2528%253DO%2529O%255BC%2540%2540H%255D1C%255BC%2540%255D%2528C%2529%2528O%2529%255BC%2540%2540H%255D2%255BC%2540H%255D1C%253DCO%255BC%2540H%255D2O%255BC%2540%2540H%255D1O%255BC%2540H%255D%2528CO%2529%255BC%2540%2540H%255D%2528O%2529%255BC%2540H%255D%2528O%2529%255BC%2540H%255D1O.png "C24H32O13")
- Zoom the structure
- CSSB00159261380
Items Overall 5 items from 5 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific CN | 3 days | China To: | 98 | 5 mg | 865.70 | |
Description: 6-O-Syringoylajugol; CAS: 144049-72-9 | ||||||
| 1st Scientific LLC | 3 days | United States To: | 98 | 5 mg | 865.70 | |
Description: 6-O-Syringoylajugol; CAS: 144049-72-9 | ||||||
| A2B Chem | 12 days | United States To: | 90 | 5 mg | 1,061.45 | |
Description: 6-O-Syringoylajugol; CAS: 144049-72-9 | ||||||
| AA BLOCKS | 12 days | United States To: | 98 | 5 mg | 1,081.30 | |
Description: 6-O-Syringoylajugol; CAS: 144049-72-9 | ||||||
| 10X CHEM | TBD | United States To: | 98 | 5 mg | 811.80 | |
Description: 6-O-Syringoylajugol; CAS: 144049-72-9 | ||||||
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