S-adenosyl-3-thio-1,8-diaminooctane
(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(1,8-diaminooctan-3-ylsulfanylmethyl)oxolane-3,4-diol
Also Known As: Adodato|Satdao|S-Adenosyl-3-thio-1,8-diaminooctane|S-Adenosyl-1,8-diamino-3-thiooctane|5'-s-(1,8-diaminooctan-3-yl)-5'-thioadenosine|J2.516.458J|3-[(5 -Adenosyl)thio]octane-1,8-diamine|Adenosine, 5'-S-(6-amino-1-(2-aminoethyl)hexyl)-5'-thio-|(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(1,8-diaminooctan-3-ylsulfanylmethyl)oxolane-3,4-diol|Adenosine, 5'-S-[6-amino-1-(2-aminoethyl) hexyl]-5'-thio|Adenosine, 5'-S-[6-amino-1-(2-aminoethyl) hexyl]-5'-thio-|(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-{[(1,8-diaminooctan-3-yl)sulfanyl]methyl}oxolane-3,4-diol|(2S,3S,4R,5R)-2-[[6-amino-1-(2-aminoethyl)hexyl]sulfanylmethyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol|2-[6-Amino-1-(2-amino-ethyl)-hexylsulfanylmethyl]-5-(6-amino-purin-9-yl)-tetrahydro-furan-3,4-diol|AAT
| Molecular Formula | C18H31N7O3S |
|---|---|
| Molecular Weight | 425.22092 g/mol |
| Topological Polar Surface Area | 171.35 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 425.22092 |
| Heavy Atoms | 29 |
| Complexity | 777.0 |
Chemical Identifiers
| CAS Number | 76426-40-9 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSC(CCCCCN)CCN)O)O)N |
Product Overview
S-adenosyl-3-thio-1,8-diaminooctane (CAS 76426-40-9), with molecular formula C18H31N7O3S and molecular weight 425.22092 g/mol. IUPAC: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(1,8-diaminooctan-3-ylsulfanylmethyl)oxolane-3,4-diol.
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