84849-10-5
Product Name:
Grayanotoxane-3,5,6,10,14,16-hexol, 14-pentanoate, (3-beta,6-beta,14R) -
Formula:
C25H42O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 454.6 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 454.29305367 g/mol |
| Monoisotopic Mass | 454.29305367 g/mol |
| Topological Polar Surface Area | 127 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 769 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |