Convalloside

Molecular Formula: C35H52O15


InChI: InChI=1/C35H52O15/c1-16-29(50-31-27(42)25(40)24(39)22(13-36)49-31)26(41)28(43)30(47-16)48-18-3-8-33(15-37)20-4-7-32(2)19(17-11-23(38)46-14-17)6-10-35(32,45)21(20)5-9-34(33,44)12-18/h14-16,18-22,24-31,36,39-45H,3-13H2,1-2H3/t16u,18-,19+,20-,21+,22u,24?,25?,26?,27?,28?,29?,30?,31?,32+,33-,34-,35-/m0/s1

InChIKey: InChIKey=BHWKWRJEHRYZOO-AJVUVOKQBS
SMILES: CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=COC(=O)C6)C)C=O)O)O)OC7C(C(C(C(O7)CO)O)O)O

Names:
    Convalloside
    NSC374118
    (3S,5S,8R,9S,10R,13R,14S,17S)-3-[3,4-dihydroxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-4H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
    13473-51-3

Registries:
    PubChem CID 341618
    PubChem ID 8141559