87532-27-2
Product Name:
Verrucarin A, 2',3'-didehydro-7'-deoxo-2'-deoxy-9,10-epoxy-7',5'-(ethylideneoxy)-9,10-dihydro-4'-hydroxy-, (9R,10S)- (9CI)
Formula:
C29H36O10
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COMPUTED DESCRIPTORS
| Molecular Weight | 544.6 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 0 |
| Exact Mass | 544.23084734 g/mol |
| Monoisotopic Mass | 544.23084734 g/mol |
| Topological Polar Surface Area | 126 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 1180 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 12 |
| Defined Bond Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |