5-(methylamino)-2-{[(2R,3R,6S,8S,9R,11R)-3,9,11-trimethyl-8-[(2R)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-1,3-benzoxazole-4-carboxylic acid
Structure Info
- Chemspace ID
- CSSB14945366139 (In-Stock Building Blocks)
- IUPAC Name
- 5-(methylamino)-2-{[(2R,3R,6S,8S,9R,11R)-3,9,11-trimethyl-8-[(2R)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-1,3-benzoxazole-4-carboxylic acid
- Mol formula
- C29H37N3O6
- Mol weight
- 524 Da
- Catalog Number(s)
- Y225934
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.38
- Heavy atoms count
- 38
- Rotatable bond count
- 7
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.551
- Polar surface area (Å)
- 127
- Hydrogen bond acceptors count
- 7
- Hydrogen bond donors count
- 3
![Chemical structure of 5-(methylamino)-2-{[(2R,3R,6S,8S,9R,11R)-3,9,11-trimethyl-8-[(2R)-1-oxo-1-(1H-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-1,3-benzoxazole-4-carboxylic acid (C29H37N3O6) - CSSB14945366139](/st/structure/200/512c8fd2a2fd8cbaf75d69cd246b435a/CNc1ccc2oc%2528C%255BC%2540H%255D3O%255BC%2540%2540%255D4%2528CC%255BC%2540H%255D3C%2529O%255BC%2540H%255D%2528%255BC%2540%2540H%255D%2528C%2529C%2528%253DO%2529c3ccc%255BnH%255D3%2529%255BC%2540H%255D%2528C%2529C%255BC%2540H%255D4C%2529nc2c1C%2528O%2529%253DO.png "C29H37N3O6")
- Zoom the structure
- CSSB14945366139
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Advanced ChemBlocks CN | 10 days | China To: | 97 | 5 mg | 235.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 97 | 25 mg | 885.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 97 | 100 mg | 2,655.00 | |
Description: Calcimycin; CAS: 52665-69-7 | ||||||
For a custom pack size or bulk
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