C8M

3-[{[(2R,3S,4R,5R)-5-(6-amino-8-methyl-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}(methyl)amino]propanamid e



Chemical Component Summary

Name3-[{[(2R,3S,4R,5R)-5-(6-amino-8-methyl-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}(methyl)amino]propanamid e
Synonyms5'-[(2-carboxamidomethyl)methylamino]-5'-deoxy-8-methyladenosine
Identifiers3-[[(2R,3S,4R,5R)-5-(6-amino-8-methyl-purin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl-methyl-amino]propanamide
FormulaC15 H23 N7 O4
Molecular Weight365.388
TypeNON-POLYMER
Isomeric SMILESCc1nc2c(ncnc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)C[N@@](C)CCC(=O)N)O)O)N
InChIInChI=1S/C15H23N7O4/c1-7-20-10-13(17)18-6-19-14(10)22(7)15-12(25)11(24)8(26-15)5-21(2)4-3-9(16)23/h6,8,11-12,15,24-25H,3-5H2,1-2H3,(H2,16,23)(H2,17,18,19)/t8-,11-,12-,15-/m1/s1
InChIKeyMAQWABZHWBDHHD-PMXXHBEXSA-N

Chemical Details

Formal Charge0
Atom Count49
Chiral Atom Count4
Bond Count51
Aromatic Bond Count10

Related Resource References

Resource NameReference
Pharos CHEMBL462656
PubChem 25181313
ChEMBL CHEMBL462656