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6009-98-9

6009-98-9 structural image
Product Name: TAUROCHENODEOXYCHOLIC ACID SODIUM SALT
Formula: C26H44NNaO6S
Synonyms: 2-([3α,7α-Dihydroxy-24-oxo-5β-cholan-24-yl]amino)ethanesulfonic acid sodium salt;3α,7α-Dihydroxy-5β-cholan-24-oic acid N-(2-sulfoethyl)amide sodium salt;Taurochenodeoxycholic acid sodium salt
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COMPUTED DESCRIPTORS

Molecular Weight 521.7 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 521.27870358 g/mol
Monoisotopic Mass 521.27870358 g/mol
Topological Polar Surface Area 135 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 864
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Sodium taurochenodeoxycholate is a cholanoid.