4. Computational chemical data
- Molecular Weight:142.909g/mol
- Molecular Formula:C21H39NO3
- Compound Is Canonicalized:True
- XLogP3-AA:
- Exact Mass:142.0399697
- Monoisotopic Mass:142.0399697
- Complexity:35.5
- Rotatable Bond Count:0
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:2
- Topological Polar Surface Area:0
- Heavy Atom Count:8
- 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:3
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