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Home > Encyclopedia > (2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid

(2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid

(2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid structure

(2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid 

structure
  • CAS No:

    33422-66-1

  • Formula:

    C10H12N6O4

  • Chemical Name:

    (2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid

  • Synonyms:

    N(6)-(N-threonylcarbonyl)adenine;N-(purin-6-ylcarbamoyl)threonine;N-(purin-6-ylcarbamoyl)threonine, (D)-isomer;N-(purin-6-ylcarbamoyl)threonine, monopotassium salt, (L)-isomer;N-(purin-6-ylcarbamoyl)threonine, monorubidium salt, tetrahydrate, (L)-isomer;N-(purin-6-ylcarbamoyl)threonine, rubidium salt, (L)-isomer;TC(6)ADE;N-(Purin-6-ylcarbamoyl)threonine;N-(Purin-6-ylcarbamoyl)-L-threonine;TC(6)Ade;NSC 144743;N(6)-(N-Threonylcarbonyl)adenine;33422-66-1;SCHEMBL9267351;Threonine, N-(purin-6-ylcarbamoyl)-, L- (8CI);L-Threonine, N-((1H-purin-6-ylamino)carbonyl)- (9CI)

(2S)-3-hydroxy-2-(7H-purin-6-ylcarbamoylamino)butanoic acid Basic Attributes

280.24 g/mol

280.09200289 g/mol

Characteristics

153 Ų

Drug Information

N(6)-(N-threonylcarbonyl)adenine

Computed Properties

Molecular Weight:280.24
XLogP3:-1.2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:280.09200289
Monoisotopic Mass:280.09200289
Topological Polar Surface Area:153
Heavy Atom Count:20
Complexity:381
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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