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102029-54-9

102029-54-9 structural image
Product Name: ADENOSINE 3'-PHOSPHATE 5'-PHOSPHOSULFATE, TETRALITHIUM SALT
Formula: C10H11Li4N5O13P2S
Synonyms: Adenosine 3ʹ-Phosphate 5ʹ-Phosphosulfate, Tetralithium Salt;PAPS, 4Li
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COMPUTED DESCRIPTORS

Molecular Weight 531.1 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 17
Rotatable Bond Count 6
Exact Mass 531.0189443 g/mol
Monoisotopic Mass 531.0189443 g/mol
Topological Polar Surface Area 296 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 823
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 5
Compound Is Canonicalized Yes