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Concept information

Preferred term

S adenosyl 4 methylthio 2 oxobutanoate  

Type

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

alt_id

  • CHEBI:12758
  • CHEBI:22033

charge

  • 0

formula

  • C15H19N5O6S

inchi

  • InChI=1S/C15H19N5O6S/c1-27(3-2-7(21)15(24)25)4-8-10(22)11(23)14(26-8)20-6-19-9-12(16)17-5-18-13(9)20/h5-6,8,10-11,14,22-23H,2-4H2,1H3,(H2-,16,17,18,24,25)/t8-,10-,11-,14-,27?/m1/s1

inchikey

  • UOKVQQMBGVMXPU-CJPDYEHRSA-N

mass

  • 397.40746

monoisotopicmass

  • 397.10560

smiles

  • C[S+](CCC(=O)C([O-])=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12

subset

  • 3_STAR

synonym EXACT

  • 4-[(5'-deoxyadenosin-5'-yl)(methyl)sulfaniumyl]-2-oxobutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:16490

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