2-Methylthio-N6-threonylcarbamoyladenosine

CAS Registry Number®

70333-82-3
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CAS Name

2-Methylthio-N6-threonylcarbamoyladenosine

Molecular Formula

C16H22N6O8S

Molecular Mass

458.45

Cite this Page

2-Methylthio-N6-threonylcarbamoyladenosine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=70333-82-3 (retrieved 2024-07-06) (CAS RN: 70333-82-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22N6O8S/c1-5(24)7(14(27)28)18-15(29)19-11-8-12(21-16(20-11)31-2)22(4-17-8)13-10(26)9(25)6(3-23)30-13/h4-7,9-10,13,23-26H,3H2,1-2H3,(H,27,28)(H2,18,19,20,21,29)/t5-,6-,7+,9-,10-,13-/m1/s1

InChIKey

InChIKey=MMNYGKPAZBIRKN-DWVDDHQFSA-N

SMILES

O[C@H]1[C@H](N2C=3C(N=C2)=C(NC(N[C@@H]([C@@H](C)O)C(O)=O)=O)N=C(SC)N3)O[C@H](CO)[C@H]1O

Canonical SMILES

O=C(O)C(NC(=O)NC1=NC(=NC2=C1N=CN2C3OC(CO)C(O)C3O)SC)C(O)C

Other Names for this Substance

  • L-Threonine, N-[[[2-(methylthio)-9-β-D-ribofuranosyl-9H-purin-6-yl]amino]carbonyl]-
  • N-[[[2-(Methylthio)-9-β-D-ribofuranosyl-9H-purin-6-yl]amino]carbonyl]-L-threonine
  • 2-Methylthio-N6-threonylcarbamoyladenosine
  • 2-Methylthio-N6-threonyl carbamoyladenosine