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28-O-[GLUCOPYRANOSYL-(1->3)-2-[3-GLUCOPYRANOSYL-(1->4)-PHENYL]-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER
SpectraBase Compound ID AHeu94h3Obt
InChI InChI=1S/C56H84O20/c1-51(2)20-21-56(30(22-51)29-13-14-35-53(5)18-17-36(60)52(3,4)34(53)16-19-54(35,6)55(29,7)23-37(56)61)50(69)76-49-46(45(31(59)26-70-49)75-48-44(68)42(66)40(64)33(25-58)73-48)74-38(62)15-10-27-8-11-28(12-9-27)71-47-43(67)41(65)39(63)32(24-57)72-47/h8-9,11-13,30-37,39-49,57-61,63-68H,10,14-26H2,1-7H3/t30?,31-,32-,33-,34?,35?,36+,37-,39-,40-,41+,42+,43-,44-,45+,46-,47-,48+,49+,53+,54-,55-,56-/m1/s1
InChIKey HZHXUJAUCGULIU-NBUFQENMSA-N
Mol Weight 1077.3 g/mol
Molecular Formula C56H84O20
Exact Mass 1076.555595 g/mol
Enantiomer InChIKey HZHXUJAUCGULIU-MZDLNJNRSA-N
Unknown Identification

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