Ajugarin I

Molecular Formula: C₂₄H₃₄O₇

InChI: InChI=1/C24H34O7/c1-15-10-20(31-17(3)26)24(14-29-16(2)25)19(6-5-8-23(24)13-30-23)22(15,4)9-7-18-11-21(27)28-12-18/h11,15,19-20H,5-10,12-14H2,1-4H3/t15-,19-,20+,22+,23+,24+/m1/s1

InChIKey: InChIKey=RNYBNBANBCQZON-PGQNDPHJBX
SMILES: CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCCC24CO4)COC(=O)C)OC(=O)C

Names:
    Ajugarin I
    C09058
    62640-05-5
    [(1S,3R,4S,4aR,8S,8aS)-8a-(acetyloxymethyl)-3,4-dimethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-oxirane]-1-yl] acetate

Registries:
    PubChem CID 173866
    PubChem ID 11250