| SpectraBase Compound ID | DTc2x3ee5OW |
|---|---|
| InChI | InChI=1S/C30H46O6/c1-17-9-14-30(24(34)35)16-15-26(3)18(22(30)29(17,6)36)7-8-19-25(2)12-11-21(31)28(5,23(32)33)20(25)10-13-27(19,26)4/h7,17,19-22,31,36H,8-16H2,1-6H3,(H,32,33)(H,34,35)/t17-,19-,20-,21+,22-,25-,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | UIEGOKVPCRANSU-LPTRQSICSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C30H46O6 |
| Exact Mass | 502.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4pb8p4b8zBz |
|---|---|
| Name | 3-BETA,19-ALPHA-DIHYDROXY-URS-12-ENE-24,28-DICARBOXYLIC-ACID |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O6 |
| InChI | InChI=1S/C30H46O6/c1-17-9-14-30(24(34)35)16-15-26(3)18(22(30)29(17,6)36)7-8-19-25(2)12-11-21(31)28(5,23(32)33)20(25)10-13-27(19,26)4/h7,17,19-22,31,36H,8-16H2,1-6H3,(H,32,33)(H,34,35)/t17-,19-,20-,21+,22-,25-,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | UIEGOKVPCRANSU-LPTRQSICSA-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 | 502.692 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS3799 |