SpectraBase Compound ID | 9rBVyQ7EZ7H |
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InChI | InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36-,37+,39-,40+,41+,45-,46+,47+,48-/m0/s1 |
InChIKey | YDZWHGJRWMQCDP-NEWLDQADSA-N |
Mol Weight | 957.1 g/mol |
Molecular Formula | C48H76O19 |
Exact Mass | 956.49808 g/mol |
SpectraBase Spectrum ID | CRs5UogExtV |
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Name | 3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID |
Compound Number | 2 |
Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H76O19 |
InChI | InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36-,37+,39-,40+,41+,45-,46+,47+,48-/m0/s1 |
InChIKey | YDZWHGJRWMQCDP-NEWLDQADSA-N |
Literature Reference Author | A.L.TAPONDJOU,T.MIYAMOTO,M.A.LACAILLE-DUBOIS |
Literature Reference Citation | PHYTOCHEM.,67,2126(2006) |
Literature Reference DOI | 10.1016/j.phytochem.2006.06.034 |
Molecular Weight | 957.120 g/mol |
Sample ID | 67128 |
Solvent | C5D5N |