Spirostan-12-one, 3-(acetyloxy)-, (3b,5a,25R)-


Chemical Name: Spirostan-12-one, 3-(acetyloxy)-, (3b,5a,25R)-
CAS Number: 915-35-5
Product Number: AG003QUD(AGN-PC-0OMQBJ)
Synonyms:
MDL No:
Molecular Formula: C29H44O5
Molecular Weight: 472.6567

Identification/Properties


Properties
MP:
241-245ºC
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
472.666g/mol
XLogP3:
5.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
472.319g/mol
Monoisotopic Mass:
472.319g/mol
Topological Polar Surface Area:
61.8A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
871
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

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NMR Spectrum


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Chemical Structure



Hecogenin acetate, a natural compound extracted from certain plants, serves as a valuable reagent in chemical synthesis. Its versatile chemical properties make it a key ingredient in the production of various organic compounds, such as steroids, pharmaceuticals, and agrochemicals. In organic synthesis, hecogenin acetate functions as a precursor for the synthesis of steroid hormones like cortisone and hydrocortisone. Additionally, this compound is utilized in the manufacturing of pharmaceuticals due to its ability to modify and enhance the biological activity of certain drugs. Furthermore, hecogenin acetate plays a crucial role in the development of agrochemicals, serving as a building block for the synthesis of plant growth regulators and pesticides. Its significance in chemical synthesis highlights its importance in the production of a wide range of essential compounds across various industries.