Olaxoside

Molecular Formula: C48H76O18


InChI: InChI=1/C48H76O18/c1-21-28(50)30(52)33(55)39(61-21)64-36-32(54)35(57)41(65-37(36)38(58)59)63-27-12-13-45(6)25(44(27,4)5)11-14-47(8)26(45)10-9-22-23-19-43(2,3)15-17-48(23,18-16-46(22,47)7)42(60)66-40-34(56)31(53)29(51)24(20-49)62-40/h9,21,23-37,39-41,49-57H,10-20H2,1-8H3,(H,58,59)/t21-,23+,24-,25+,26-,27+,28+,29-,30-,31+,32-,33-,34-,35-,36+,37+,39+,40+,41-,45+,46-,47-,48+/m1/s1/f/h58H

InChIKey: InChIKey=FWGUQBCYEUGRPQ-PWQZMEEHDL
SMILES: CC1C(C(C(C(O1)OC2C(C(C(OC2C(=O)O)OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)O)O)O)O)O

Names:
    C08962
    Olaxoside
    (2S,3S,4R,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aR,14aR,14bS)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxane-2-carboxylic acid
    80135-33-7

Registries:
    PubChem CID 441935
    PubChem ID 11154