Transvaalin

Molecular Formula: C₃₆H₅₂O₁₃

InChI: InChI=1/C36H52O13/c1-17-26(39)27(40)29(42)32(46-17)49-31-24(15-37)48-33(30(43)28(31)41)47-20-8-11-34(2)19(14-20)5-6-23-22(34)9-12-35(3)21(10-13-36(23,35)44)18-4-7-25(38)45-16-18/h4,7,14,16-17,20-24,26-33,37,39-44H,5-6,8-13,15H2,1-3H3/t17-,20+,21-,22+,23-,24+,26-,27+,28-,29-,30+,31-,32+,33+,34+,35-,36+/m1/s1

InChIKey: InChIKey=KKOLMSSIDZXPLS-VSQYVSJXBG
SMILES: CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3CCC4(C5CCC6(C(CCC6(C5CCC4=C3)O)C7=COC(=O)C=C7)C)C)CO)O)O)O

Names:
    BRN 0076216
    EINECS 204-721-3
    Glucoproscillaridin A
    NSC 7525
    Scillaglykosid A [German]
    SCILLAREN A
    Scillaren + rhamnose + glucose [German]
    Transvaalin
    14-beta-Hydroxy-3-beta-scillobiosidobufa-4,20,22-trienolide
    4-18-00-01659 (Beilstein Handbook Reference)
    5-[(3S,8R,9S,10R,13R,14S,17S)-3-[(2S,3S,4R,5S,6S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

Registries:
    PubChem CID 31310
    PubChem ID 173369