Spirostan-3-ol, (3b,5b,25S)-


Chemical Name: Spirostan-3-ol, (3b,5b,25S)-
CAS Number: 126-19-2
Product Number: AG000QO5(AGN-PC-0O0RTD)
Synonyms:
MDL No:
Molecular Formula: C27H44O3
Molecular Weight: 416.6365

Identification/Properties


Computed Properties
Molecular Weight:
416.646g/mol
XLogP3:
6.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
416.329g/mol
Monoisotopic Mass:
416.329g/mol
Topological Polar Surface Area:
38.7A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
694
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
12
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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