84893-93-6
Product Name:
Grayanotoxane-3,5,6,10,14,16-hexol, 14-(2-hydroxypropanoate), (3β,6β,14R)- (9CI)
Formula:
C23H38O8
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 442.5 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 442.25666817 g/mol |
| Monoisotopic Mass | 442.25666817 g/mol |
| Topological Polar Surface Area | 148 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 771 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |