SpectraBase Compound ID | 5odQcbTPRiI |
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InChI | InChI=1S/C48H76O20/c1-43(2)14-16-48(42(62)68-40-34(58)30(54)28(52)22(19-50)64-40)17-15-46(6)20(26(48)37(43)59)8-9-24-45(5)12-11-25(44(3,4)23(45)10-13-47(24,46)7)65-41-36(32(56)31(55)35(66-41)38(60)61)67-39-33(57)29(53)27(51)21(18-49)63-39/h8,21-37,39-41,49-59H,9-19H2,1-7H3,(H,60,61)/t21-,22-,23?,24?,25+,26?,27+,28-,29+,30+,31+,32+,33-,34-,35+,36-,37+,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
InChIKey | YWRJCOBEOLLKHX-UOMTVJSYSA-N |
Mol Weight | 973.1 g/mol |
Molecular Formula | C48H76O20 |
Exact Mass | 972.492995 g/mol |
SpectraBase Spectrum ID | 1jUPWO4gLqY |
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Name | ILEXOSIDE-LI;3-O-BETA-[GALACTOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-SIARESINOLIC-ACID-28-O-[GLUCOPYRANOSYL]-ESTER |
Compound Number | 96 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H76O20 |
InChI | InChI=1S/C48H76O20/c1-43(2)14-16-48(42(62)68-40-34(58)30(54)28(52)22(19-50)64-40)17-15-46(6)20(26(48)37(43)59)8-9-24-45(5)12-11-25(44(3,4)23(45)10-13-47(24,46)7)65-41-36(32(56)31(55)35(66-41)38(60)61)67-39-33(57)29(53)27(51)21(18-49)63-39/h8,21-37,39-41,49-59H,9-19H2,1-7H3,(H,60,61)/t21-,22-,23?,24?,25+,26?,27+,28-,29+,30+,31+,32+,33-,34-,35+,36-,37+,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
InChIKey | YWRJCOBEOLLKHX-UOMTVJSYSA-N |
Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
Molecular Weight | 973.119 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN1326 |