73319-30-9
Product Name:
3,17-bis-deacetylvecuronium
Formula:
C30H53BrN2O2
Synonyms:
1-[(2β,3α,5α,16β,17β)-3,17-Dihydroxy-2-(1-piperidinyl)androstan-16-yl]-1-methylpiperidinium bromide
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COMPUTED DESCRIPTORS
| Molecular Weight | 553.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 552.32904 g/mol |
| Monoisotopic Mass | 552.32904 g/mol |
| Topological Polar Surface Area | 43.7 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 746 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 10 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |