Molecule

(3aR,4aS,5S,5aR,6aR)-5a-methyl-3-methylidene-5-(3-oxobutyl)-3a,4,4a,5,6,6a-hexahydrocyclopropa[f][1]benzofuran-2-one

Chemical Information

Molecular Image
InChI InChI=1S/C15H20O3/c1-8(16)4-5-11-12-6-10-9(2)14(17)18-13(10)7-15(11,12)3/h10-13H,2,4-7H2,1,3H3/t10-,11+,12+,13-,15-/m1/s1
SMILES CC(=O)CC[C@H]1[C@H]2[C@@]1(C[C@@H]3[C@H](C2)C(=C)C(=O)O3)C
InChI Key AGIQIKMGJVLKMA-NLRWUALESA-N
Exact Mass 248.141 g/mol

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol83138
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    CHEMBL3315226 chembl
    164879 pubchem
    PD125224 probes_and_drugs
    NASDET CCDC
    267214 brenda
    DTXSID90938585 comptox
    Molport-001-742-430 molport
    The data in this table is sourced from UniChem at EBI.