(5S,8S)-8-benzoyl-2-[(Z,1S,2S)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione


Chemical Name: (5S,8S)-8-benzoyl-2-[(Z,1S,2S)-1,2-dihydroxyhex-3-enyl]-9-hydroxy-8-methoxy-3-methyl-1-oxa-7-azaspiro[4.4]non-2-ene-4,6-dione
CAS Number: 58523-30-1
Product Number: AG00EBM4(AGN-PC-00UD30)
Synonyms:
MDL No:
Molecular Formula: C22H25NO8
Molecular Weight: 431.4358

Identification/Properties


Computed Properties
Molecular Weight:
431.441g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
431.158g/mol
Monoisotopic Mass:
431.158g/mol
Topological Polar Surface Area:
142A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
814
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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