Molecule Info: CHEMBL1233771
Smiles:
CCOC(=O)c1oc2c(c1C)c(OC[C@H](C[NH2+]C(C)C)O)ccc2
Netcharge:
1
InChIKey:
QVJVMNUTCGTBCH-DKGGQNPDNA-O
InChI:
1/C18H25NO5/c1-5-22-18(21)17-12(4)16-14(7-6-8-15(16)24-17)23-10-13(20)9-19-11(2)3/h6-8,11,13,19-20H,5,9-10H2,1-4H3/p+1/t13-/m0/s1/fC18H26NO5/h19H/q+1
InChIcol:
1
More information (from its Standard Form):
CHEMBL1233771
Complex structures in which this molecule appears :
Complex Structure ID: 97
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
