Molecule Info: CHEMBL321570
Smiles:
CO[C@@]12CC[C@@]34[C@@]5([C@@H]1N[C@H]([C@]2(C)C3)c1ccccc1)CCN([C@@H]4Cc1c5cc(O)cc1)C
InChIKey:
MDISNMPRWVXCDE-CLYKQLRXNA-N
InChI:
1/C28H34N2O2/c1-25-17-26-11-12-28(25,32-3)24(29-23(25)18-7-5-4-6-8-18)27(26)13-14-30(2)22(26)15-19-9-10-20(31)16-21(19)27/h4-10,16,22-24,29,31H,11-15,17H2,1-3H3/t22-,23+,24+,25+,26-,27+,28+/m1/s1
InChIcol:
1
More information (from its Standard Form):
CHEMBL321570
References in which this molecule is mentioned:
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
