| SpectraBase Compound ID | BkQxhmpOdV2 |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-22,31,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20+,21-,22-,26+,27-,28-,29-,30+/m1/s1 |
| InChIKey | LJORXTIGOHMBOS-OTRVPSFMSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jpcu8DdBK4d |
|---|---|
| Name | 2-ALPHA,19-ALPHA-DIHYDROXY-3-OXO-URS-12-EN-28-OIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,19-22,31,35H,9-16H2,1-7H3,(H,33,34)/t17-,19-,20+,21-,22-,26+,27-,28-,29-,30+/m1/s1 |
| InChIKey | LJORXTIGOHMBOS-OTRVPSFMSA-N |
| Literature Reference Author | S.TANIGUCHI,Y.IMAYOSHI,E.KOBAYASHI,Y.TAKAMATSU,H.ITO,T.HATAN O,H.SAKAGAMI,H.TOKUD |
| Literature Reference Citation | PHYTOCHEM.,59,315(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00455-1 |
| Molecular Weight | 486.692 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2584 |