![#5;3-ALPHA,11-ALPHA-DIHYDROXY-LUP-20(29)-ENE-23,28-DIOIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/1R7dQ6D1vVJ/structure.png?h=300&w=458 "#5;3-ALPHA,11-ALPHA-DIHYDROXY-LUP-20(29)-ENE-23,28-DIOIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | DKfHL44HvH9 |
|---|---|
| InChI | InChI=1S/C48H76O20/c1-19(2)21-8-13-48(15-14-45(5)22(28(21)48)16-23(50)38-44(4)11-10-27(51)47(7,42(60)61)26(44)9-12-46(38,45)6)43(62)68-41-35(58)32(55)30(53)25(66-41)18-63-39-36(59)33(56)37(24(17-49)65-39)67-40-34(57)31(54)29(52)20(3)64-40/h20-41,49-59H,1,8-18H2,2-7H3,(H,60,61)/t20-,21+,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39-,40+,41+,44+,45-,46-,47+,48+/m1/s1 |
| InChIKey | JYJSDPJHFJZKFG-FOYVCOILSA-N |
| Mol Weight | 973.1 g/mol |
| Molecular Formula | C48H76O20 |
| Exact Mass | 972.492995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1R7dQ6D1vVJ |
|---|---|
| Name | #5;3-ALPHA,11-ALPHA-DIHYDROXY-LUP-20(29)-ENE-23,28-DIOIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H76O20 |
| InChI | InChI=1S/C48H76O20/c1-19(2)21-8-13-48(15-14-45(5)22(28(21)48)16-23(50)38-44(4)11-10-27(51)47(7,42(60)61)26(44)9-12-46(38,45)6)43(62)68-41-35(58)32(55)30(53)25(66-41)18-63-39-36(59)33(56)37(24(17-49)65-39)67-40-34(57)31(54)29(52)20(3)64-40/h20-41,49-59H,1,8-18H2,2-7H3,(H,60,61)/t20-,21+,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39-,40+,41+,44+,45-,46-,47+,48+/m1/s1 |
| InChIKey | JYJSDPJHFJZKFG-FOYVCOILSA-N |
| Literature Reference Author | T.V.SUNG,W.STEGLICH,G.ADAM |
| Literature Reference Citation | PHYTOCHEM.,30,2349(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83647-4 |
| Molecular Weight | 973.119 g/mol |
| Solvent | CD3OD:D2O=4:1 |
| Source File Reference | UWSI25228 |