Molecule

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

Chemical Information

Molecular Image
InChI InChI=1S/C24H31NO4/c1-3-5-11-29-24-19-15-25-9-8-17-13-23(28-10-4-2)22(27)14-18(17)20(25)12-16(19)6-7-21(24)26/h6-7,13-14,20,26-27H,3-5,8-12,15H2,1-2H3/t20-/m0/s1
SMILES CCCCOC1=C2CN3CCC4=CC(OCCC)=C(O)C=C4[C@@H]3CC2=CC=C1O
InChI Key CIXHXASWJFMKLE-FQEVSTJZSA-N

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol1819
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL5425375 chembl
    172460258 pubchem
    50620542 bindingdb
    The data in this table is sourced from UniChem at EBI.