Chemical Component Summary

Name5'-{[2-(aminooxy)ethyl](methyl)amino}-5'-deoxy-8-methyladenosine
Identifiers(2R,3R,4S,5R)-2-(6-amino-8-methyl-purin-9-yl)-5-[(2-aminooxyethyl-methyl-amino)methyl]oxolane-3,4-diol
FormulaC14 H23 N7 O4
Molecular Weight353.377
TypeNON-POLYMER
Isomeric SMILESCc1nc2c(ncnc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)C[N@@](C)CCON)O)O)N
InChIInChI=1S/C14H23N7O4/c1-7-19-9-12(15)17-6-18-13(9)21(7)14-11(23)10(22)8(25-14)5-20(2)3-4-24-16/h6,8,10-11,14,22-23H,3-5,16H2,1-2H3,(H2,15,17,18)/t8-,10-,11-,14-/m1/s1
InChIKeyMIGFZONTOHGZMB-IDTAVKCVSA-N

Chemical Details

Formal Charge0
Atom Count48
Chiral Atom Count4
Bond Count50
Aromatic Bond Count10

Related Resource References

Resource NameReference
PubChem 25181314
ChEMBL CHEMBL1187584