N,N'-Methylenebis(adenosine diphosphate)
(2R,3R,4S,5R)-2-[6-[[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: Me-Bis(ADP)|Methylene-bis-adenosine|Adenosine, N,N''-methylenebis-|KST-1A4213|KST-1A4214|N,N'-Methylenebis(adenosine diphosphate)|N6,N6''-methanediyl-bis-adenosine|(2R,3R,4S,5R)-2-[6-[[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol|(2r,3r,4s,5r,2'r,3'r,4's,5'r)-2,2'-[methanediylbis(imino-9h-purine-6,9-diyl)]bis[5-(hydroxymethyl)tetrahydrofuran-3,4-diol](non-preferred name)
| Molecular Formula | C21H26N10O8 |
|---|---|
| Molecular Weight | 546.1935 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 251.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 546.1935 |
| Monoisotopic Mass | 546.1935 |
| Heavy Atoms | 39 |
| Complexity | 776.0 |
Chemical Identifiers
| CAS Number | 36115-82-9 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NCNC4=C5C(=NC=N4)N(C=N5)[C@H]6[C@@H]([C@@H]([C@H](O6)CO)O)O |
| InChIKey | LZYDDSMPHLWIAE-NAGRZYTCSA-N |
Product Overview
N,N'-Methylenebis(adenosine diphosphate) (CAS 36115-82-9), with molecular formula C21H26N10O8 and molecular weight 546.1935 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-[[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
N,N'-Methylenebis(adenosine diphosphate) is a custom synthesis product. We offer services from milligram to kilogram scale.
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