| SpectraBase Compound ID | Eq4ehhlbymW |
|---|---|
| InChI | InChI=1S/C37H58O10/c1-20-11-16-37(31(42)45-8)18-17-33(3)21(28(37)36(20,6)43)9-10-23-32(2)14-13-25(47-29-27(40)26(39)22(38)19-46-29)35(5,30(41)44-7)24(32)12-15-34(23,33)4/h9,20,22-29,38-40,43H,10-19H2,1-8H3/t20-,22-,23-,24-,25+,26+,27-,28-,29+,32-,33-,34-,35+,36-,37+/m1/s1 |
| InChIKey | SCAVQRMMNXCDRU-UBRRNTBHSA-N |
| Mol Weight | 662.9 g/mol |
| Molecular Formula | C37H58O10 |
| Exact Mass | 662.402998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9JUIbb8BLtG |
|---|---|
| Name | 19-ALPHA-HYDROXY-URS-12-ENE-24,28-DIOATE-3-O-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H58O10 |
| InChI | InChI=1S/C37H58O10/c1-20-11-16-37(31(42)45-8)18-17-33(3)21(28(37)36(20,6)43)9-10-23-32(2)14-13-25(47-29-27(40)26(39)22(38)19-46-29)35(5,30(41)44-7)24(32)12-15-34(23,33)4/h9,20,22-29,38-40,43H,10-19H2,1-8H3/t20-,22-,23-,24-,25+,26+,27-,28-,29+,32-,33-,34-,35+,36-,37+/m1/s1 |
| InChIKey | SCAVQRMMNXCDRU-UBRRNTBHSA-N |
| Literature Reference Author | R.AGARWAL,R.SINGH,I.R.SIDDIQUI,J.SINGH |
| Literature Reference Citation | PHYTOCHEM.,38,935(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00747-H |
| Molecular Weight | 662.862 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS3798 |