Cholan-24-oic acid, 3,12-dihydroxy-, methyl ester, (3a,5b,12a)-


Chemical Name: Cholan-24-oic acid, 3,12-dihydroxy-, methyl ester, (3a,5b,12a)-
CAS Number: 3245-38-3
Product Number: AG00BXNV(AGN-PC-0O8X2E)
Synonyms:
MDL No:
Molecular Formula: C25H42O4
Molecular Weight: 406.59858

Identification/Properties


Properties
MP:
62-69°C
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
406.607g/mol
XLogP3:
5.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
406.308g/mol
Monoisotopic Mass:
406.308g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
620
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:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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