IVH

2-(butylsulfanyl)adenosine


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Chemical Component Summary

Name2-(butylsulfanyl)adenosine
Identifiers(2R,3R,4S,5R)-2-(6-azanyl-2-butylsulfanyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
FormulaC14 H21 N5 O4 S
Molecular Weight355.413
TypeNON-POLYMER
Isomeric SMILESCCCCSc1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N
InChIInChI=1S/C14H21N5O4S/c1-2-3-4-24-14-17-11(15)8-12(18-14)19(6-16-8)13-10(22)9(21)7(5-20)23-13/h6-7,9-10,13,20-22H,2-5H2,1H3,(H2,15,17,18)/t7-,9-,10-,13-/m1/s1
InChIKeyJUZWTKSKLZRPBL-QYVSTXNMSA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count4
Bond Count47
Aromatic Bond Count10

Related Resource References

Resource NameReference
PubChem 10689555
ChEMBL CHEMBL1233689