| SpectraBase Compound ID | 9tLvCus8TT2 |
|---|---|
| InChI | InChI=1S/C36H56O9/c1-18(2)19-10-15-36(31(42)43)17-16-34(6)20(24(19)36)8-9-22-33(5)13-12-23(32(3,4)21(33)11-14-35(22,34)7)44-30-27(39)25(37)26(38)28(45-30)29(40)41/h19-28,30,37-39H,1,8-17H2,2-7H3,(H,40,41)(H,42,43)/t19-,20+,21-,22+,23-,24+,25-,26-,27+,28-,30+,33-,34+,35+,36-/m0/s1 |
| InChIKey | SQYXYJWZICEBBS-XMCZRVDCSA-N |
| Mol Weight | 632.8 g/mol |
| Molecular Formula | C36H56O9 |
| Exact Mass | 632.392433 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6mSbH3EbJs9 |
|---|---|
| Name | 3-BETA-HYDROXYLUP-20(29)-EN-28-OIC-ACID-3-O-BETA-D-GLUCURONOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O9 |
| InChI | InChI=1S/C36H56O9/c1-18(2)19-10-15-36(31(42)43)17-16-34(6)20(24(19)36)8-9-22-33(5)13-12-23(32(3,4)21(33)11-14-35(22,34)7)44-30-27(39)25(37)26(38)28(45-30)29(40)41/h19-28,30,37-39H,1,8-17H2,2-7H3,(H,40,41)(H,42,43)/t19-,20+,21-,22+,23-,24+,25-,26-,27+,28-,30+,33-,34+,35+,36-/m0/s1 |
| InChIKey | SQYXYJWZICEBBS-XMCZRVDCSA-N |
| Literature Reference Author | A.S.WANAS,K.MATSUNAMI,H.OTSUKA,S.Y.DESOUKEY,M.A.FOUAD,M.S.KA MEL |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,1596(2010) |
| Literature Reference DOI | 10.1248/cpb.58.1596 |
| Molecular Weight | 632.835 g/mol |
| Source File Reference | UWBT3988 |