Molecule

(1S,6R,13S)-16,17-dimethoxy-6-prop-1-en-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

Chemical Information

Molecular Image
InChI InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3/t16-,20-,21+/m1/s1
SMILES CC(=C)[C@H]1CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@H]4C3=O)OC)OC
InChI Key JUVIOZPCNVVQFO-HBGVWJBISA-N
Exact Mass 394.142 g/mol

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol29089
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    DB11457 drugbank
    CHEBI:28201 chebi
    LMPK12060007 lipidmaps
    970 rcsb_pdb
    CHEMBL429023 chembl
    29388856 surechembl
    42253 surechembl
    6758 pubchem
    03L9OT429T fdasrs
    970 pdbe
    PD002240 probes_and_drugs
    PAXWAN CCDC
    777 brenda
    HMDB0034436 hmdb
    DTXSID6021248 comptox
    FDB012837 foodb
    50135527 bindingdb
    The data in this table is sourced from UniChem at EBI.