Molecule

(13aS)-3,9-dipropoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,10-diol

Chemical Information

Molecular Image
InChI InChI=1S/C23H29NO4/c1-3-9-27-22-12-16-7-8-24-14-18-15(11-19(24)17(16)13-21(22)26)5-6-20(25)23(18)28-10-4-2/h5-6,12-13,19,25-26H,3-4,7-11,14H2,1-2H3/t19-/m0/s1
SMILES CCCOC1=C(O)C=C2C(=C1)CCN1CC3=C(OCCC)C(O)=CC=C3C[C@@H]21
InChI Key MCNXDINEERCWGB-IBGZPJMESA-N

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol8050
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL5438487 chembl
    172468851 pubchem
    50620541 bindingdb
    The data in this table is sourced from UniChem at EBI.