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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate acid derivative > glucosiduronic acid > abacavir 5'-glucuronide
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosiduronic acid > glucosiduronic acid > abacavir 5'-glucuronide

Preferred term

abacavir 5'-glucuronide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C20H26N6O7

has_functional_parent

has_role

inchi

  • InChI=1S/C20H26N6O7/c21-20-24-16(23-9-2-3-9)11-17(25-20)26(7-22-11)10-4-1-8(5-10)6-32-19-14(29)12(27)13(28)15(33-19)18(30)31/h1,4,7-10,12-15,19,27-29H,2-3,5-6H2,(H,30,31)(H3,21,23,24,25)/t8-,10+,12+,13+,14-,15+,19-/m1/s1

inchikey

  • WGTDUQBKKUUVMK-OLMRCODSSA-N

mass

  • 462.45640

monoisotopicmass

  • 462.18630

smiles

  • Nc1nc(NC2CC2)c2ncn([C@@H]3C[C@H](CO[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3)c2n1

subset

  • 3_STAR

synonym EXACT

  • {(1S,4R)-4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]cyclopent-2-en-1-yl}methyl beta-D-glucopyranosiduronic acid

synonym RELATED

  • 361W
  • abacavir 5'-glucosiduronic acid
  • abacavir glucosiduronic acid
  • abacavir glucuronide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:64189

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