[(3S,4S,5S,8S,9S,12S)-12-[(2S,3S,6R,8S,9S)-3,9-dimethyl-8-[(3R)-3-methyl-4-oxo-pentyl]-1,7-dioxaspiro[5.5]undecan-2-yl]-5,9-dihydroxy-4-methoxy-2,8-dimethyl-7-oxo-tridecan-3-yl] (3R)-3-hydroxy-3-(4-methyl-2,5-dioxo-3-furyl)propanoate

Molecular Formula: C41H66O13


InChI: InChI=1/C41H66O13/c1-21(2)36(51-34(47)20-31(45)35-27(8)39(48)52-40(35)49)38(50-10)32(46)19-30(44)26(7)29(43)13-11-24(5)37-25(6)16-18-41(54-37)17-15-23(4)33(53-41)14-12-22(3)28(9)42/h21-26,29,31-33,36-38,43,45-46H,11-20H2,1-10H3/t22-,23+,24+,25-,26-,29-,31+,32+,33-,36+,37-,38-,41+/m0/s1/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,13+1,14+1,16+1,17+1,18+1,19+1,20+1,21+1,22+1,23+1,24+1,25+1,26+1,27+1,28+1,29+1,31+1,33+1,35+1,37+1,39+1

InChIKey: InChIKey=RFCWHQNNCOJYTR-PZYXSIJLFX
SMILES: CC1CCC2(CCC(C(O2)C(C)CCC(C(C)C(=O)CC(C(C(C(C)C)OC(=O)CC(C3=C(C(=O)OC3=O)C)O)OC)O)O)C)OC1CCC(C)C(=O)C

Names:
    [(3S,4S,5S,8S,9S,12S)-12-[(2S,3S,6R,8S,9S)-3,9-dimethyl-8-[(3R)-3-methyl-4-oxo-pentyl]-1,7-dioxaspiro[5.5]undecan-2-yl]-5,9-dihydroxy-4-methoxy-2,8-dimethyl-7-oxo-tridecan-3-yl] (3R)-3-hydroxy-3-(4-methyl-2,5-dioxo-3-furyl)propanoate

Registries:
    PubChem CID 10843027
    PubChem ID 15884451