1249-75-8
Product Name:
3-ALPHA-HYDROXY-5-BETA-CHOLAN-24-OIC ACID METHYL ESTER
Formula:
C25H42O3
Synonyms:
3α-Hydroxy-5β-cholan-24-oic acid methyl ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 390.6 g/mol |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 390.31339520 g/mol |
| Monoisotopic Mass | 390.31339520 g/mol |
| Topological Polar Surface Area | 46.5 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 588 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 9 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |