Cas no 7558-29-4 (9H-Purin-6-amine,9-hexulofuranosyl- (9CI))

9H-Purin-6-amine,9-hexulofuranosyl- (9CI) structure
7558-29-4 structure
Product Name:9H-Purin-6-amine,9-hexulofuranosyl- (9CI)
CAS No:7558-29-4
MF:C11H15N5O5
MW:297.267301797867
CID:562137
Update Time:2022-07-27

9H-Purin-6-amine,9-hexulofuranosyl- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 9H-Purin-6-amine,9-hexulofuranosyl- (9CI)
    • Adenine,9-hexulofuranosyl- (8CI)
    • 9H-Purin-6-amine, 9-hexulofuranosyl-
    • 9H-Purin-6-amine, 9-hexulofuranosyl- (9CI)
    • Inchi: 1S/C11H15N5O5/c12-9-6-10(14-3-13-9)16(4-15-6)11(2-18)8(20)7(19)5(1-17)21-11/h3-5,7-8,17-20H,1-2H2,(H2,12,13,14)
    • InChI Key: BNZYRKVSCLSXSJ-UHFFFAOYSA-N
    • SMILES: C(C1(N2C=NC3C(=NC=NC2=3)N)C(C(O)C(CO)O1)O)O

Computed Properties

  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 4
  • Rotatable Bond Count: 0
  • Complexity: 35.2
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.3
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