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TRAGOPOGONOSIDE-G;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-ECHINOCYSTIC-ACID-28-O-[2-COUMAROYLOXY-XYLOPYRANOSYL]-ESTER
SpectraBase Compound ID DeyJeL2VrLS
InChI InChI=1S/C57H82O21/c1-52(2)21-22-57(51(70)78-49-45(38(63)31(60)26-72-49)75-37(62)16-11-27-9-12-28(59)13-10-27)30(23-52)29-14-15-34-54(5)19-18-36(53(3,4)33(54)17-20-55(34,6)56(29,7)24-35(57)61)74-50-46(42(67)41(66)44(76-50)47(69)71-8)77-48-43(68)40(65)39(64)32(25-58)73-48/h9-14,16,30-36,38-46,48-50,58-61,63-68H,15,17-26H2,1-8H3/b16-11+/t30?,31-,32-,33?,34?,35-,36+,38+,39+,40+,41+,42+,43-,44+,45-,46-,48+,49+,50-,54+,55-,56-,57-/m1/s1
InChIKey BCBSFBSGZZERMG-PAGCPMKKSA-N
Mol Weight 1103.3 g/mol
Molecular Formula C57H82O21
Exact Mass 1102.53486 g/mol
Enantiomer InChIKey BCBSFBSGZZERMG-AENYAONISA-N
Unknown Identification

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