Pregna-1,4-diene-3,20-dione,9,11-epoxy-17-hydroxy-16-methyl-21-(1-oxopropoxy)-, (9b,11b,16b)-


Chemical Name: Pregna-1,4-diene-3,20-dione,9,11-epoxy-17-hydroxy-16-methyl-21-(1-oxopropoxy)-, (9b,11b,16b)-
CAS Number: 205105-83-5
Product Number: AG00C360(AGN-PC-0QV0D3)
Synonyms:
MDL No:
Molecular Formula: C25H32O6
Molecular Weight: 428.51798

Identification/Properties


Computed Properties
Molecular Weight:
428.525g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
428.22g/mol
Monoisotopic Mass:
428.22g/mol
Topological Polar Surface Area:
93.2A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
934
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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