DAP1_000648

Molecular Formula: C21H21ClO3


InChI: InChI=1/C21H21ClO3/c1-5-13-6-8-16-19(24)11(2)12(3)20(25)21(16,4)18(13)15-10-14(22)7-9-17(15)23/h5-7,9-10,16,18,23H,1,8H2,2-4H3/t16-,18+,21+/m0/s1

InChIKey: InChIKey=LFVNLOWCNVTHOP-YRISNDGFBK
SMILES: CC1=C(C(=O)C2(C(C1=O)CC=C(C2C3=C(C=CC(=C3)Cl)O)C=C)C)C

Names:
    DAP1_000648
    (4aR,8R,8aS)-8-(5-chloro-2-hydroxy-phenyl)-7-ethenyl-2,3,8a-trimethyl-5,8-dihydro-4aH-naphthalene-1,4-dione

Registries:
    PubChem CID 6637634
    PubChem ID 11255482