Cholan-24-oic acid, 3,6-dihydroxy-, monosodium salt, (3a,5b,6a)-


Chemical Name: Cholan-24-oic acid, 3,6-dihydroxy-, monosodium salt, (3a,5b,6a)-
CAS Number: 10421-49-5
Product Number: AG003QZ8(AGN-PC-0OT26B)
Synonyms:
MDL No:
Molecular Formula: C24H39NaO4
Molecular Weight: 414.5538

Identification/Properties


Properties
BP:
547.1°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Computed Properties
Molecular Weight:
414.562g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
414.275g/mol
Monoisotopic Mass:
414.275g/mol
Topological Polar Surface Area:
80.6A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
612
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
10
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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