Molecule

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

Chemical Information

Molecular Image
InChI InChI=1S/C22H26BrNO4/c1-3-7-28-21-8-13-5-6-24-12-16-15(9-18(24)14(13)10-19(21)25)17(23)11-20(26)22(16)27-4-2/h8,10-11,18,25-26H,3-7,9,12H2,1-2H3/t18-/m0/s1
SMILES CCCOC1=C(O)C=C2C(=C1)CCN1CC3=C(OCC)C(O)=CC(Br)=C3C[C@@H]21
InChI Key BGGURFWLEHSLEY-SFHVURJKSA-N
Exact Mass 448.300 g/mol

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol1985
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL5435602 chembl
    168475865 pubchem
    50620534 bindingdb
    The data in this table is sourced from UniChem at EBI.