601-57-0
Product Name:
4-Cholesten-3-one
Formula:
C27H44O
Synonyms:
110829;3-Keto-4-cholestene;3-Oxo-4-cholestene;4-Cholesten-3-one
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Melting Point | 79 - 82 °C |
| Kovats Retention Index | 3245 |
COMPUTED DESCRIPTORS
| Molecular Weight | 384.6 g/mol |
|---|---|
| XLogP3 | 8.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 5 |
| Exact Mass | 384.339216023 g/mol |
| Monoisotopic Mass | 384.339216023 g/mol |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 630 |
| 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 |
PRODUCT INTRODUCTION
description
Cholest-4-en-3-one is a cholestanoid that is cholest-4-ene substituted by an oxo group at position 3. It has a role as a human metabolite and a plant metabolite. It is a cholestanoid and a 3-oxo-Delta(4) steroid.