Pregn-4-ene-3,20-dione,21-(3-carboxy-1-oxopropoxy)-11,17-dihydroxy-, (11b)-


Chemical Name: Pregn-4-ene-3,20-dione,21-(3-carboxy-1-oxopropoxy)-11,17-dihydroxy-, (11b)-
CAS Number: 2203-97-6
Product Number: AG00I4AZ(AGN-PC-0QYLPV)
Synonyms:
MDL No:
Molecular Formula: C25H34O8
Molecular Weight: 462.5327

Identification/Properties


Computed Properties
Molecular Weight:
462.539g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
462.225g/mol
Monoisotopic Mass:
462.225g/mol
Topological Polar Surface Area:
138A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
908
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
7
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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