6042-32-6
Product Name:
TAUROLITHOCHOLIC ACID SODIUM SALT
Formula:
C26H44NNaO5S
Synonyms:
3α-Hydroxy-5β-cholan-24-oic acid N-(2-sulfoethyl)amide;Taurolithocholic acid sodium salt
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COMPUTED DESCRIPTORS
| Molecular Weight | 505.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 505.28378896 g/mol |
| Monoisotopic Mass | 505.28378896 g/mol |
| Topological Polar Surface Area | 115 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 832 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |