UC-773587

Chemical Information
| CAS Number | 116679-69-7 |
| PubChem CID | 103891 |
| IUPAC Name | 2-(7-hydroxy-19-oxo-2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(22),3(12),4(9),5,7,10,13,15,17,20-decaen-13-yl)benzoic acid |
| Molecular Formula | C28H16O5 |
| Molecular Weight | 432.4 |
| XLogP | 4.1 |
| Topological Polar Surface Area | 83.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 1040 |
| Property | Value |
|---|---|
| Molecular Weight | 432.4 |
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 432.09977361 |
| Monoisotopic Mass | 432.09977361 |
| Topological Polar Surface Area | 83.8 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 1040 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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