47676-48-2
Product Name:
5BETA-CHOLANIC ACID-3ALPHA,7ALPHA,12ALPHA-TRIOL ETHYL ESTER
Formula:
C26H44O5
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 436.6 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 6 |
Exact Mass | 436.31887450 g/mol |
Monoisotopic Mass | 436.31887450 g/mol |
Topological Polar Surface Area | 87 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 666 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 11 |
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
Ethyl cholate is a natural product found in Streptomyces parvulus with data available.