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83701-16-0

83701-16-0 structural image
Product Name: LITHOCHOLIC-2,2,4,4-D4 ACID
Formula: C24H36D4O3
Synonyms: (3a,5?)-3-Hydroxycholan-24-oic-2,2,4,4-d4 acid
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COMPUTED DESCRIPTORS

Molecular Weight 380.6 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 380.32285212 g/mol
Monoisotopic Mass 380.32285212 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 574
Isotope Atom Count 4
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

PRODUCT INTRODUCTION

description

Lithocholic acid-2,2,4,4-d4 is a deuterated compound and a lithocholic acid.