Cas no 6936-84-1 (9H-Purin-6-amine, 9-a-D-fructofuranosyl- (9CI))

9H-Purin-6-amine, 9-a-D-fructofuranosyl- (9CI) structure
6936-84-1 structure
Product Name:9H-Purin-6-amine, 9-a-D-fructofuranosyl- (9CI)
CAS No:6936-84-1
MF:C11H15N5O5
MW:297.267301797867
CID:513861
PubChem ID:237254
Update Time:2025-04-19

9H-Purin-6-amine, 9-a-D-fructofuranosyl- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 9H-Purin-6-amine, 9-a-D-fructofuranosyl- (9CI)
    • (2S,3S,4R,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
    • NSC 53104
    • BNZYRKVSCLSXSJ-UHFFFAOYSA-N
    • DTXSID00871853
    • NSC-40584
    • 9-.beta.-D-Psicofuranosyladenine
    • 9H-Purin-6-amine, 9-.beta.-D-psicofuranosyl-
    • 9-D-Psicofuranosyl-6-aminopurine
    • 1'-(Hydroxymethyl)adenosine
    • CHEMBL2004810
    • Adenine, 9-.beta.-D-psicofuranosyl-
    • U 9586
    • 6936-84-1
    • ADENINE, 9-B ( )-D-PSICOFURANYOSYL-
    • Adenine, 9.beta.-D-psicofuranosyl-
    • 9H-Purine, 6-amino-9-.beta.-D-psicofuranosyl-
    • 9-.beta.-D-Psicofuranosyl-9H-purin-6-amine
    • WLN: T56 BN DN FN HNJ IZ D- BT5OTJ B1Q CQ DQ E1Q
    • 6-Amino-9-D-psicofuranosylpurine
    • NSC53104
    • Adenine, 9-beta-D-psicofuranyosyl-
    • 2-(6-Amino-9H-purin-9-yl)-2,5-bis(hydroxymethyl)tetrahydro-3,4-furandiol
    • SCHEMBL691066
    • 7558-29-4
    • NCI60_004305
    • Psicofuranosyladenine
    • NSC-53104
    • 2-(6-aminopurin-9-yl)-2,5-bis(hydroxymethyl)oxolane-3,4-diol
    • 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: O1C(CO)C(C(C1(CO)N1C=NC2C(N)=NC=NC1=2)O)O

Computed Properties

  • Exact Mass: 297.10731860g/mol
  • Monoisotopic Mass: 297.10731860g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 390
  • 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: -2.2
  • Topological Polar Surface Area: 160?2
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