Structure Info
- Chemspace ID
- CSSS00161002385 (In-Stock Screening Compounds)
- IUPAC Name
- (4S)-4-[(1'S,2'S,3R,3aS,4S,4'S,7'S,7aR,8'R,12'R,15'S)-15'-(acetyloxy)-4-hydroxy-2',6,7',11'-tetramethyl-2,6'-dioxo-3a,4,7,7a-tetrahydro-2H-5'-oxaspiro[1-benzofuran-3,13'-tetracyclo[10.2.1.0¹,¹⁰.0⁴,⁸]pentadecan]-10'-en-5-yl]pentyl acetate
- Mol formula
- C34H46O9
- Mol weight
- 599 Da
- Catalog Number(s)
- ArZ-UP480260, BBP05034, CFN89501, CSC161002385, FS-6905, HY-N7337, ZX-CY002036
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.81
- Heavy atoms count
- 43
- Rotatable bond count
- 8
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.764
- Polar surface area (Å)
- 125
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00161002385
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