| SpectraBase Compound ID | IiRLGXwVxPp |
|---|---|
| InChI | InChI=1S/C35H54O9/c1-30(2)22-9-12-34(6)23(32(22,4)11-10-24(30)44-27-26(38)25(37)21(36)18-43-27)8-7-19-20-17-31(3,28(39)40)13-15-35(20,29(41)42)16-14-33(19,34)5/h7,20-27,36-38H,8-18H2,1-6H3,(H,39,40)(H,41,42)/t20-,21+,22-,23+,24-,25-,26+,27-,31+,32-,33+,34+,35-/m0/s1 |
| InChIKey | VMWNZPOPSHQKPF-LTCUZEEASA-N |
| Mol Weight | 618.8 g/mol |
| Molecular Formula | C35H54O9 |
| Exact Mass | 618.376783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EBAtZ8MSC8u |
|---|---|
| Name | 3-O-BETA-D-XYLOPYRANOSYL-3-BETA-HYDROXY-OLEAN-12-ENE-28,29-DIOIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O9 |
| InChI | InChI=1S/C35H54O9/c1-30(2)22-9-12-34(6)23(32(22,4)11-10-24(30)44-27-26(38)25(37)21(36)18-43-27)8-7-19-20-17-31(3,28(39)40)13-15-35(20,29(41)42)16-14-33(19,34)5/h7,20-27,36-38H,8-18H2,1-6H3,(H,39,40)(H,41,42)/t20-,21+,22-,23+,24-,25-,26+,27-,31+,32-,33+,34+,35-/m0/s1 |
| InChIKey | VMWNZPOPSHQKPF-LTCUZEEASA-N |
| Literature Reference Author | S.S.YU,D.Q.YU,X.T.LIANG |
| Literature Reference Citation | PHYTOCHEM.,38,695(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00706-Y |
| Molecular Weight | 618.808 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4905 |