31824-11-0
Product Name:
2-Butenoic acid,2-methyl-,(3aR,4S,6E,9S,10Z,11aS)-2,3,3a,4,5,8,9,11a-octahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-ylester
Formula:
C20H26O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 346.4 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 346.17802393 g/mol |
| Monoisotopic Mass | 346.17802393 g/mol |
| Topological Polar Surface Area | 72.8 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 668 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |