Cas no 89705-22-6 (5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-)

5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]- structure
89705-22-6 structure
Product Name:5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-
CAS No:89705-22-6
MF:C18H23N6O7P
MW:466.384984254837
CID:591950
PubChem ID:71407712
Update Time:2025-04-19

5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]- Chemical and Physical Properties

Names and Identifiers

    • 5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-
    • ((2R,3S,4R,5R)-5-(6-((4-Aminophenethyl)amino)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate
    • 89705-22-6
    • {[(2R,3S,4R,5R)-5-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
    • Inchi: 1S/C18H23N6O7P/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(26)14(25)12(31-18)7-30-32(27,28)29/h1-4,8-9,12,14-15,18,25-26H,5-7,19H2,(H,20,21,22)(H2,27,28,29)/t12-,14-,15-,18-/m1/s1
    • InChI Key: BHSFILYSUXINQK-SCFUHWHPSA-N
    • SMILES: P(=O)(O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C=NC3C(=NC=NC2=3)NCCC2C=CC(=CC=2)N)O1)O)O

Computed Properties

  • Exact Mass: 466.13658409g/mol
  • Monoisotopic Mass: 466.13658409g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 8
  • Complexity: 666
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.6
  • Topological Polar Surface Area: 198?2

5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]- Suppliers

NewCan Biotech Limited
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(CAS:89705-22-6)5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-
Order Number:NC14195
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Quantity:10g
Purity:97%
Pricing Information Last Updated:Friday, 18 July 2025 16:01
Price ($):Price inquiry
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NewCan Biotech Limited
(CAS:89705-22-6)5'-Adenylic acid, N-[2-(4-aminophenyl)ethyl]-
NC14195
Purity:97%
Quantity:10g
Price ($):Inquiry
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