Cas no 42173-86-4 (9H-Purin-6-amine,9-(2-O-methyl-b-D-arabinofuranosyl)-)

9H-Purin-6-amine,9-(2-O-methyl-b-D-arabinofuranosyl)- structure
42173-86-4 structure
Product Name:9H-Purin-6-amine,9-(2-O-methyl-b-D-arabinofuranosyl)-
CAS No:42173-86-4
MF:C11H15N5O4
MW:281.267901659012
CID:335261
PubChem ID:317398
Update Time:2025-04-19

9H-Purin-6-amine,9-(2-O-methyl-b-D-arabinofuranosyl)- Chemical and Physical Properties

Names and Identifiers

    • 9H-Purin-6-amine,9-(2-O-methyl-b-D-arabinofuranosyl)-
    • 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-methoxyoxolan-3-ol
    • 2-O-methyla-denosine
    • 2'-O-Methyladenosine
    • 2-O-Methyladenosine
    • AC1L7VWK
    • ACMC-20aa4m
    • CHEMBL429968
    • CTK8H5992
    • NSC249005
    • NS00066973
    • NSC-249005
    • SY074163
    • 2 inverted exclamation mark -O-Methyladenosine
    • M2291
    • NS00015020
    • SCHEMBL16359957
    • DTXSID40312038
    • Q15632794
    • PD093861
    • FT-0649901
    • 42173-86-4
    • Inchi: 1S/C11H15N5O4/c1-19-8-7(18)5(2-17)20-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)
    • InChI Key: FPUGCISOLXNPPC-UHFFFAOYSA-N
    • SMILES: O1C(CO)C(C(C1N1C=NC2C(N)=NC=NC1=2)OC)O

Computed Properties

  • Exact Mass: 281.11255
  • Monoisotopic Mass: 281.11240398g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 349
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.5
  • Topological Polar Surface Area: 129?2

Experimental Properties

  • PSA: 128.54
  • LogP: -0.74470
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