Molecule Info: N-ethyl-5'-carboxamido adenosine
Smiles:
CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N


InChIKey:
JADDQZYHOWSFJD-NLVLOVCBNA-N

InChI:
1/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1/f/h14H,13H2

InChIcol:
1

+info (from its Standard Form):
N-ethyl-5'-carboxamido adenosine

Complex structures in which this molecule appears :
Complex Structure ID: 30 Complex Structure ID: 45

References in which this molecule is mentioned:

National Center for Biotechnology Information. PubChem Compound Database. None. Information for this molecule was obtained via PubChem API and RDKit tools. None None (None). doi: None.


Ismael Rodríguez-Espigares, Mariona Torrens-Fontanals, et al.. 2020. GPCRmd uncovers the dynamics of the 3D-GPCRome. Nature methods 17 (8). doi: 10.1038/s41592-020-0884-y.



Image of the Specific State: