5. Computational chemical data
- Molecular Weight:300.81g/mol
- Molecular Formula:C28H46N2O12
- Compound Is Canonicalized:True
- XLogP3-AA:
- Exact Mass:300.0811600
- Monoisotopic Mass:300.0811600
- Complexity:269
- Rotatable Bond Count:4
- Hydrogen Bond Donor Count:2
- Hydrogen Bond Acceptor Count:6
- Topological Polar Surface Area:104
- Heavy Atom Count:19
- Defined Atom Stereocenter Count:0
- Undefined Atom Stereocenter Count:0
- Defined Bond Stereocenter Count:0
- Undefined Bond Stereocenter Count:0
- Isotope Atom Count:0
- Covalently-Bonded Unit Count:2
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