Molecule

(13aS)-12-bromo-9-(2-ethoxyethoxy)-3-propoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,10-diol

Chemical Information

Molecular Image
InChI InChI=1S/C24H30BrNO5/c1-3-7-30-23-10-15-5-6-26-14-18-17(11-20(26)16(15)12-21(23)27)19(25)13-22(28)24(18)31-9-8-29-4-2/h10,12-13,20,27-28H,3-9,11,14H2,1-2H3/t20-/m0/s1
SMILES CCCOC1=C(O)C=C2C(=C1)CCN1CC3=C(OCCOCC)C(O)=CC(Br)=C3C[C@@H]21
InChI Key RMKVCRINIVDQQR-FQEVSTJZSA-N

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol9725
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL5420387 chembl
    172455077 pubchem
    50620539 bindingdb
    The data in this table is sourced from UniChem at EBI.