Molecule

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

Chemical Information

Molecular Image
InChI InChI=1S/C27H37NO4/c1-3-5-7-8-14-31-26-16-20-11-12-28-18-22-19(15-23(28)21(20)17-25(26)30)9-10-24(29)27(22)32-13-6-4-2/h9-10,16-17,23,29-30H,3-8,11-15,18H2,1-2H3/t23-/m0/s1
SMILES CCCCCCOC1=C(O)C=C2C(=C1)CCN1CC3=C(OCCCC)C(O)=CC=C3C[C@@H]21
InChI Key OOMIAFXMQARGDX-QHCPKHFHSA-N

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol7050
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL5414499 chembl
    172450677 pubchem
    50620556 bindingdb
    The data in this table is sourced from UniChem at EBI.