Compound Summary (CID 25200755) |
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  Compound Information CID 25200755 Create Date: 2009-03-31 Suppressed Compound Properties and Descriptors | Properties | | | | Molecular Weight | | 675.47844 [g/mol] | | Molecular Formula | | C23H31O23-3 | | XLogP3-AA | | -5.7 | | H-Bond Donor | | 10 | | H-Bond Acceptor | | 23 | | Rotatable Bond Count | | 6 | | | | | Exact Mass | | 675.125612 | | MonoIsotopic Mass | | 675.125612 | | Topological Polar Surface Area | | 387 | | Heavy Atom Count | | 46 | | Formal Charge | | -3 | | Complexity | | 1080 | | Isotope Atom Count | | 0 | | Defined Atom Stereocenter Count | | 18 | | Undefined Atom Stereocenter Count | | 1 | | Defined Bond Stereocenter Count | | 0 | | Undefined Bond Stereocenter Count | | 0 | | Covalently-Bonded Unit Count | | 1 | | | | | Feature 3D Acceptor Count | | 23 | | Feature 3D Donor Count | | 10 | | Feature 3D Anion Count | | 3 | | Feature 3D Ring Count | | 4 | | Effective Rotor Count | | 13.8 | | Conformer Sampling RMSD | | 1.4 | | CID Conformer Count | | 165 |
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Old Version Substance Information |
