Barbaloin

Barbaloin - definition from Biology-Online.org

[aloin (Science: chemistry) a bitter purgative principle in aloes.

Molecular Formula: C21H22O9


InChI: InChI=1/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14-,17-,19+,20-,21+/m1/s1

InChIKey: InChIKey=AFHJQYHRLPMKHU-WEZNYRQKBT
SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2C4C(C(C(C(O4)CO)O)O)O)CO)O

Names:
    aloin
    Barbaloin
    C10305
    (10R)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
    1415-73-2

Registries:
    PubChem CID 14989
    PubChem ID 12491