2-Methylthio-N6-(cis-hydroxyisopentenyl)adenosine

CAS Registry Number®

52049-48-6

CAS Name

2-Methylthio-N6-(cis-hydroxyisopentenyl)adenosine

Molecular Formula

C16H23N5O5S

Molecular Mass

397.45

Cite this Page

2-Methylthio-N6-(cis-hydroxyisopentenyl)adenosine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52049-48-6 (retrieved 2024-11-23) (CAS RN: 52049-48-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H23N5O5S/c1-8(5-22)3-4-17-13-10-14(20-16(19-13)27-2)21(7-18-10)15-12(25)11(24)9(6-23)26-15/h3,7,9,11-12,15,22-25H,4-6H2,1-2H3,(H,17,19,20)/b8-3-/t9-,11-,12-,15-/m1/s1

InChIKey

InChIKey=QEWSGVMSLPHELX-RFLXNSOUSA-N

SMILES

N(C/C=C(\CO)/C)C1=C2C(N(C=N2)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)=NC(SC)=N1

Canonical SMILES

OCC(=CCNC1=NC(=NC2=C1N=CN2C3OC(CO)C(O)C3O)SC)C

Other Names for this Substance

  • Adenosine, N-[(2Z)-4-hydroxy-3-methyl-2-buten-1-yl]-2-(methylthio)-
  • Adenosine, N-(4-hydroxy-3-methyl-2-butenyl)-2-(methylthio)-, (Z)-
  • Adenosine, N-[(2Z)-4-hydroxy-3-methyl-2-butenyl]-2-(methylthio)-
  • N-[(2Z)-4-Hydroxy-3-methyl-2-buten-1-yl]-2-(methylthio)adenosine
  • 6-(4-Hydroxy-3-methyl-cis-2-butenylamino)-2-methylthio-9-β-D-ribofuranosylpurine

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