Cas no 49564-60-5 (Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro-)

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- structure
49564-60-5 structure
Product Name:Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro-
CAS No:49564-60-5
MF:C10H15ClN5O13P3
MW:541.626083612442
CID:932483
PubChem ID:162565
Update Time:2024-10-29

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Chemical and Physical Properties

Names and Identifiers

    • DIINOSINE PENTAPHOSPHATE
    • 2- CHLOROADENOSINE- 5'- O- TRIPHOSPHATE ( 2-CL-ATP )
    • 2-Chloro-ATP
    • 2-Chloroadenosine-5-triphosphate
    • 2-Chloro-Adenosinetriphosphate
    • 2-chloroadenosine 5'-(tetrahydrogen triphosphate)
    • 2-ClATP
    • GTPL1716
    • 2-chloroadenosine-5'-triphosphate
    • BDBM50422385
    • Q27071884
    • 2-chloro-9-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-9H-purin-6-amine
    • [(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphat
    • 2-Chlorodenosin-5'- triphosphate
    • 2-Chloroadenosine 5'-triphosphate
    • 2-Chloro-ATP
    • Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro-
    • 49564-60-5
    • D0U8HD
    • [(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
    • (((2R,3S,4R,5R)-5-(6-Amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)triphosphoric acid
    • PD050591
    • CHEMBL1368696
    • C10-H15-Cl-N5-O13-P3
    • C10H15ClN5O13P3
    • (((2R,3S,4R,5R)-5-(6-Amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)triphosphoricacid
    • SCHEMBL2027164
    • DTXSID50964269
    • [[(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
    • 2-Chloroadenosine 5'-triphosphate
    • 2-Chlorodenosin-5'-triphosphate
    • ((2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl)methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
    • Inchi： 1S/C10H15ClN5O13P3/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t3-,5-,6-,9-/m1/s1
    • InChI Key： RNGCVFCOKZEZFL-UUOKFMHZSA-N
    • SMILES： ClC1N=C(C2=C(N=1)N(C=N2)[C@H]1[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1)O)O)N

Computed Properties

  • Exact Mass: 540.9567742g/mol
  • Monoisotopic Mass: 540.9567742g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 17
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 8
  • Complexity: 836
  • 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: -4.7
  • Topological Polar Surface Area: 279

Experimental Properties

  • Solubility: H2O: soluble

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Security Information

  • WGK Germany：3

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHENG KE LU SI SHENG WU JI SHU
sc-288070-5 μmol
2-Chloroadenosine triphosphate sodium salt,
 49564-60-5 ≥95%
5 μmol
 ￥1504.00 2023-09-05
SHENG KE LU SI SHENG WU JI SHU
sc-5l
2-Chloroadenosine triphosphate sodium salt
 49564-60-5
5l
 ￥2256.00 2024-11-04

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Production Method

Production Method 1

Reaction Conditions
1.1R:POCl3, S:MeCN
1.2R:S:CCl4
2.1R:NH3, S:EtOH
3.1R:POCl3, R:(MeO)3PO
3.2R:2Bu3N ?H4P2O7
3.3R:H2O
Reference
Protonation Studies of Modified Adenine and Adenine Nucleotides by Theoretical Calculations and 15N NMR
By Major, Dan T. et al, Journal of Organic Chemistry, 2002, 67(3), 790-802

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Raw materials

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Preparation Products

Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro- Related Literature

Related Categories

49564-60-5 (Adenosine 5'-(tetrahydrogen triphosphate), 2-chloro-) Related Products

Recommended suppliers
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zhangzhou Sinobioway Peptide Co.,Ltd.
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan ChemNorm Biotech Co.,Ltd.
Essenoi Fine Chemical Co., Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd