Structure Info
- Chemspace ID
- CSCS00159280100 (Synthesis)
- IUPAC Name
- (3S,4S,6aR,6bS,8aS,12aS,14bR)-8a-({[(2S,3R,4S,5R,6R)-6-({[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)-3,5-dihydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}carbonyl)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4-carboxylic acid
- Mol formula
- C54H86O25
- Mol weight
- 1135 Da
- Catalog Number(s)
- CSC159280100, NP-020661, T125476
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -1.79
- Heavy atoms count
- 79
- Rotatable bond count
- 14
- Number of rings
- 9
- Carbon bond saturation, Fsp3
- 0.925
- Polar surface area (Å)
- 411
- Hydrogen bond acceptors count
- 24
- Hydrogen bond donors count
- 15
- Zoom the structure
- CSCS00159280100
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, € | Qty |
|---|---|---|---|---|---|---|
| Targetmol Chemicals Inc | TBD | United States To: | 90 | 1 mg | POA | |
Description: Vaccaroid A is a useful organic compound for research related to life sciences. The catalog number is T125476 and the CAS number is 191543-13-2.; CAS: 191543-13-2 | ||||||
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