SDCCGMLS-0066968.P001

Molecular Formula: C₄₃H₃₂O₂₀

InChI: InChI=1/C43H32O20/c44-17-7-23(46)21-12-33(62-42(58)15-3-25(48)36(54)26(49)4-15)40(60-31(21)9-17)14-1-19-20(11-30(53)39(57)35(19)38(56)29(52)2-14)41-34(13-22-24(47)8-18(45)10-32(22)61-41)63-43(59)16-5-27(50)37(55)28(51)6-16/h1-11,33-34,40-41,44-51,53-55,57H,12-13H2,(H,52,56)/t33-,34-,40-,41-/m1/s1/f/h56H

InChIKey: InChIKey=ZEASWHWETFMWCV-FYVYLCDEDL
SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=O)C(=C4C(=C3)C(=CC(=C4O)O)C5C(CC6=C(C=C(C=C6O5)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O

Names:
    SDCCGMLS-0066968.P001
    [(2S,3R)-2-[3-[(2S,3R)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-chroman-2-yl]-6,8,9-trihydroxy-5-oxo-11-bicyclo[5.4.0]undeca-1,3,6,8,10-pentaenyl]-5,7-dihydroxy-chroman-3-yl] 3,4,5-trihydroxybenzoate

Registries:
    PubChem CID 467320
    PubChem ID 11537995