γ-Cyclodextrin (hydrate)

Chemical Information
| CAS Number | 91464-90-3 |
| PubChem CID | 71311509 |
| IUPAC Name | (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36S,38R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R,50R,51R,52R,53R,54R,55R,56R)-5,10,15,20,25,30,35,40-octakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol;hydrate |
| Molecular Formula | C48H82O41 |
| Molecular Weight | 1315.1 |
| Topological Polar Surface Area | 634 |
| Hydrogen Bond Donor Count | 25 |
| Hydrogen Bond Acceptor Count | 41 |
| Rotatable Bond Count | 8 |
| Heavy Atom Count | 89 |
| Formal Charge | 0 |
| Complexity | 1720 |
| Property | Value |
|---|---|
| Molecular Weight | 1315.1 |
| Hydrogen Bond Donor Count | 25 |
| Hydrogen Bond Acceptor Count | 41 |
| Rotatable Bond Count | 8 |
| Exact Mass | 1314.4331520 |
| Monoisotopic Mass | 1314.4331520 |
| Topological Polar Surface Area | 634 Ų |
| Heavy Atom Count | 89 |
| Formal Charge | 0 |
| Complexity | 1720 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 40 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |
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