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145451-96-3

145451-96-3 structural image
Product Name: (3R,4S,5S,6S)-1-AZA-5-CARBOXYL-4-HYDROXY-6-ISOPROPYL-3-METHYL-7-OXABICYCLO[3.3.0]OCTAN-2-ONE
Formula: C11H17NO5
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COMPUTED DESCRIPTORS

Molecular Weight 243.26 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 243.11067264 g/mol
Monoisotopic Mass 243.11067264 g/mol
Topological Polar Surface Area 87.1 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 369
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes