2-[(4-{[5-(acetyloxy)-6-[(acetyloxy)methyl]-3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[(acetyloxy)methyl]-5-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl)oxy]-4-hydroxy-5-(hydroxymethyl)-2-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxolan-3-yl benzoate
Structure Info
- Chemspace ID
- CSSB06744482939 (In-Stock Building Blocks)
- IUPAC Name
- 2-[(4-{[5-(acetyloxy)-6-[(acetyloxy)methyl]-3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[(acetyloxy)methyl]-5-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl)oxy]-4-hydroxy-5-(hydroxymethyl)-2-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxolan-3-yl benzoate
- Mol formula
- C62H76O35
- Mol weight
- 1381 Da
- Catalog Number(s)
- AD285623, BD02530463, BUP21484, TN2424
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.72
- Heavy atoms count
- 97
- Rotatable bond count
- 32
- Number of rings
- 8
- Carbon bond saturation, Fsp3
- 0.548
- Polar surface area (Å)
- 513
- Hydrogen bond acceptors count
- 29
- Hydrogen bond donors count
- 13
![Chemical structure of 2-[(4-{[5-(acetyloxy)-6-[(acetyloxy)methyl]-3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[(acetyloxy)methyl]-5-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl)oxy]-4-hydroxy-5-(hydroxymethyl)-2-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxolan-3-yl benzoate (C62H76O35) - CSSB06744482939](/st/structure/200/743a98d20043431bd4d4cb3d5f183188/COc1cc%2528C%253DCC%2528%253DO%2529OC2C%2528COC%2528C%2529%253DO%2529OC%2528OC3OC%2528CO%2529C%2528O%2529C%2528O%2529C3O%2529C%2528OC3%2528COC%2528%253DO%2529C%253DCc4ccc%2528O%2529cc4%2529OC%2528CO%2529C%2528O%2529C3OC%2528%253DO%2529c3ccccc3%2529C2OC2OC%2528COC%2528C%2529%253DO%2529C%2528OC%2528C%2529%253DO%2529C%2528OC3OC%2528CO%2529C%2528O%2529C%2528O%2529C3O%2529C2O%2529ccc1O.png "C62H76O35")
- Zoom the structure
- CSSB06744482939
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 1 mg | 775.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 5 mg | 1,665.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 25 mg | 3,335.00 | |
Description: Tenuifoliose A; CAS: 139682-01-2 | ||||||
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