| SpectraBase Compound ID | 55B3TSZkFpQ |
|---|---|
| InChI | InChI=1S/C31H46O4/c1-18(17-24(32)19(2)20(3)27(34)35)21-11-15-31(8)23-9-10-25-28(4,5)26(33)13-14-29(25,6)22(23)12-16-30(21,31)7/h18,20-21,25H,2,9-17H2,1,3-8H3,(H,34,35)/t18-,20?,21-,25+,29-,30-,31+/m1/s1 |
| InChIKey | GHDRSYXGPSCEMR-WGUXTVTPSA-N |
| Mol Weight | 482.7 g/mol |
| Molecular Formula | C31H46O4 |
| Exact Mass | 482.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IdMewD4MyUU |
|---|---|
| Name | QUERCINIC-ACID-B;24-METHYLENE-3,23-DIOXOLANOST-8-EN-26-OIC-ACID |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O4 |
| InChI | InChI=1S/C31H46O4/c1-18(17-24(32)19(2)20(3)27(34)35)21-11-15-31(8)23-9-10-25-28(4,5)26(33)13-14-29(25,6)22(23)12-16-30(21,31)7/h18,20-21,25H,2,9-17H2,1,3-8H3,(H,34,35)/t18-,20?,21-,25+,29-,30-,31+/m1/s1 |
| InChIKey | GHDRSYXGPSCEMR-WGUXTVTPSA-N |
| Literature Reference Author | J.ROESECKE,W.A.KOENIG |
| Literature Reference Citation | PHYTOCHEM.,54,757(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00130-8 |
| Molecular Weight | 482.704 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1451 |