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STEPHANOSIDE_Q;12-O-CINNAMOYL-PREGN-5-EN-20-ONE-3-BETA,8-BETA,12-BETA,14-BETA,17-BETA-PENTAOL_3-O-BETA-THEVETOPYRANOSYL-(1->4)-BETA-OLEANDROPYRANOS
SpectraBase Compound ID IQWib5kGgKh
InChI InChI=1S/C58H86O20/c1-30-47(61)52(69-11)48(62)53(73-30)78-51-33(4)72-46(28-40(51)68-10)77-50-32(3)71-45(27-39(50)67-9)76-49-31(2)70-44(26-38(49)66-8)74-37-20-21-54(6)36(25-37)19-22-57(64)41(54)29-42(75-43(60)18-17-35-15-13-12-14-16-35)55(7)56(63,34(5)59)23-24-58(55,57)65/h12-19,30-33,37-42,44-53,61-65H,20-29H2,1-11H3/b18-17+/t30-,31+,32-,33+,37-,38-,39+,40+,41+,42+,44-,45+,46-,47-,48-,49+,50-,51+,52+,53+,54-,55+,56+,57-,58+/m0/s1
InChIKey ROCQRTLTAPQWRP-RHQAIVQESA-N
Mol Weight 1103.3 g/mol
Molecular Formula C58H86O20
Exact Mass 1102.571245 g/mol
Enantiomer InChIKey ROCQRTLTAPQWRP-VJGOJWEBSA-N
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