Chemical Component Summary

Name5'-N-(2-HYDROXYL)ETHYL CARBOXYAMIDO ADENOSINE
Synonyms(2S,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXY-N-(2-HYDROXYETHYL)TETRAHYDROFURAN-2-CARBOXAMIDE
Identifiers(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-(2-hydroxyethyl)oxolane-2-carboxamide
FormulaC12 H16 N6 O5
Molecular Weight324.293
TypeNON-POLYMER
Isomeric SMILESc1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)NCCO)O)O)N
InChIInChI=1S/C12H16N6O5/c13-9-5-10(16-3-15-9)18(4-17-5)12-7(21)6(20)8(23-12)11(22)14-1-2-19/h3-4,6-8,12,19-21H,1-2H2,(H,14,22)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
InChIKeyYLPQAZPIFSHMAY-FLNNQWSLSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count4
Bond Count41
Aromatic Bond Count10

Related Resource References

Resource NameReference
Pharos CHEMBL1234591
PubChem 215492
ChEMBL CHEMBL1234591