| SpectraBase Compound ID | E6bVfGpMPvQ |
|---|---|
| InChI | InChI=1S/C36H58O9/c1-19-10-15-36(30(42)45-29-27(41)26(40)25(39)21(18-37)44-29)17-16-33(5)20(28(36)35(19,7)43)8-9-23-32(4)13-12-24(38)31(2,3)22(32)11-14-34(23,33)6/h8,19,21-29,37-41,43H,9-18H2,1-7H3/t19-,21-,22+,23-,24+,25-,26+,27-,28-,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | RRIMLWHUVCZACL-HPUCWRFUSA-N |
| Mol Weight | 634.9 g/mol |
| Molecular Formula | C36H58O9 |
| Exact Mass | 634.408083 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KMPawf5m3GF |
|---|---|
| Name | 3-BETA,19-ALPHA-DIHYDROXY-URS-12-EN-28-OIC-ACID-28-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O9 |
| InChI | InChI=1S/C36H58O9/c1-19-10-15-36(30(42)45-29-27(41)26(40)25(39)21(18-37)44-29)17-16-33(5)20(28(36)35(19,7)43)8-9-23-32(4)13-12-24(38)31(2,3)22(32)11-14-34(23,33)6/h8,19,21-29,37-41,43H,9-18H2,1-7H3/t19-,21-,22+,23-,24+,25-,26+,27-,28-,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | RRIMLWHUVCZACL-HPUCWRFUSA-N |
| Literature Reference Author | W.SUN,Z.L.ZHANG,X.LIU,S.ZHANG,L.HE,Z.WANG,G.S.WANG |
| Literature Reference Citation | MOLECULES,17,7629(2012) |
| Literature Reference DOI | 10.3390/molecules17077629 |
| Molecular Weight | 634.851 g/mol |
| Sample ID | 961 |
| Solvent | DMSO-D6 |