Chemical Component Summary

NameN-[3-(4-aminophenyl)propyl]adenosine
Identifiers(2~{R},3~{R},4~{S},5~{R})-2-[6-[3-(4-aminophenyl)propylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
FormulaC19 H24 N6 O4
Molecular Weight400.432
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1CCCNc2c3c(ncn2)n(cn3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N
InChIInChI=1S/C19H24N6O4/c20-12-5-3-11(4-6-12)2-1-7-21-17-14-18(23-9-22-17)25(10-24-14)19-16(28)15(27)13(8-26)29-19/h3-6,9-10,13,15-16,19,26-28H,1-2,7-8,20H2,(H,21,22,23)/t13-,15-,16-,19-/m1/s1
InChIKeyZGGQXDUSBXMHFX-NVQRDWNXSA-N

Chemical Details

Formal Charge0
Atom Count53
Chiral Atom Count4
Bond Count56
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 141311798