Hypercalin B

Molecular Formula: C₃₃H₄₂O₅

InChI: InChI=1/C33H42O5/c1-20(2)13-17-33(18-14-21(3)4)30(36)25(19-26-24(22(5)6)15-16-32(26,7)38)29(35)27(31(33)37)28(34)23-11-9-8-10-12-23/h8-14,24,26,34-35,38H,5,15-19H2,1-4,6-7H3/b28-27+/t24-,26-,32+/m1/s1

InChIKey: InChIKey=XMVYTWVWYJLUHK-LHHMKPCHBY
SMILES: CC(=CCC1(C(=O)C(=C(C(=C(C2=CC=CC=C2)O)C1=O)O)CC3C(CCC3(C)O)C(=C)C)CC=C(C)C)C

Names:
    C09941
    Hypercalin B
    (4E)-3-hydroxy-2-[[(1R,2S,5S)-2-hydroxy-2-methyl-5-prop-1-en-2-yl-cyclopentyl]methyl]-4-(hydroxy-phenyl-methylidene)-6,6-bis(3-methylbut-2-enyl)cyclohex-2-ene-1,5-dione
    125583-45-1

Registries:
    PubChem CID 5281562
    PubChem ID 12127