| SpectraBase Compound ID | 8agpaO1Oki6 |
|---|---|
| InChI | InChI=1S/C43H68O14/c1-38(2)17-21-20-10-11-24-42(7,41(20,6)15-14-40(21,5)26(46)18-38)13-12-23-39(3,4)27(16-25(45)43(23,24)8)55-37-34(31(50)30(49)33(56-37)35(52)53-9)57-36-32(51)29(48)28(47)22(19-44)54-36/h10-11,22-34,36-37,44-51H,12-19H2,1-9H3/t22-,23+,24+,25-,26-,27+,28-,29+,30+,31+,32-,33+,34-,36+,37-,40-,41-,42-,43+/m1/s1 |
| InChIKey | JMVIBNVOOFDQKU-HXKZRBRNSA-N |
| Mol Weight | 809.0 g/mol |
| Molecular Formula | C43H68O14 |
| Exact Mass | 808.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G9HZsc0FwpZ |
|---|---|
| Name | 3-BETA-O-BETA-GLUCOPYRANOSYL-(1->2)-BETA-GLUCURONOPYRANOSYL-OLEAN-11,13(18)-DIEN-1-BETA,3-BETA,22-BETA-TRIOL |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O14 |
| InChI | InChI=1S/C43H68O14/c1-38(2)17-21-20-10-11-24-42(7,41(20,6)15-14-40(21,5)26(46)18-38)13-12-23-39(3,4)27(16-25(45)43(23,24)8)55-37-34(31(50)30(49)33(56-37)35(52)53-9)57-36-32(51)29(48)28(47)22(19-44)54-36/h10-11,22-34,36-37,44-51H,12-19H2,1-9H3/t22-,23+,24+,25-,26-,27+,28-,29+,30+,31+,32-,33+,34-,36+,37-,40-,41-,42-,43+/m1/s1 |
| InChIKey | JMVIBNVOOFDQKU-HXKZRBRNSA-N |
| Literature Reference Author | Z.Z.IBRAHEIM,H.A.HASSANEAN,D.W.BISHAY |
| Literature Reference Citation | PHYTOCHEM.,62,1201(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00620-9 |
| Molecular Weight | 809.005 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU29622 |