| SpectraBase Compound ID | 2pITnGg8Yms |
|---|---|
| InChI | InChI=1S/C36H58O9/c1-18-11-14-36(30(41)42)16-15-33(6)20(27(36)35(18,8)43)9-10-23-32(5)17-21(37)28(31(3,4)22(32)12-13-34(23,33)7)45-29-26(40)25(39)24(38)19(2)44-29/h9,18-19,21-29,37-40,43H,10-17H2,1-8H3,(H,41,42)/t18-,19-,21-,22?,23?,24+,25+,26-,27?,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | MXQDZWQIRGRELN-JGOBFUPQSA-N |
| Mol Weight | 634.9 g/mol |
| Molecular Formula | C36H58O9 |
| Exact Mass | 634.408083 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E0anvTalQW0 |
|---|---|
| Name | TORMENTIC-ACID-3-BETA-O-BETA-D-FUCOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58O9 |
| InChI | InChI=1S/C36H58O9/c1-18-11-14-36(30(41)42)16-15-33(6)20(27(36)35(18,8)43)9-10-23-32(5)17-21(37)28(31(3,4)22(32)12-13-34(23,33)7)45-29-26(40)25(39)24(38)19(2)44-29/h9,18-19,21-29,37-40,43H,10-17H2,1-8H3,(H,41,42)/t18-,19-,21-,22?,23?,24+,25+,26-,27?,28+,29+,32+,33-,34-,35-,36+/m1/s1 |
| InChIKey | MXQDZWQIRGRELN-JGOBFUPQSA-N |
| Literature Reference Author | N.D.TOMMASI,L.RASTRELLI,J.CUMANDA,G.SPERANZA,C.PIZZA |
| Literature Reference Citation | PHYTOCHEM.,42,163(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00884-5 |
| Molecular Weight | 634.851 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU3253 |