| SpectraBase Compound ID | Lfm6qV2ICQC |
|---|---|
| InChI | InChI=1S/C31H52O11/c1-7-29(6)12-17(33)25-30(16-40-21(34)13-28(4,5)38)10-8-9-27(2,3)19(30)11-20(31(25,39)15-29)42-26-24(37)23(36)22(35)18(14-32)41-26/h7,17-20,22-26,32-33,35-39H,1,8-16H2,2-6H3/t17-,18-,19+,20+,22-,23+,24-,25-,26+,29-,30-,31+/m1/s1 |
| InChIKey | QYIUUYJMNTUPAA-KVKTXYALSA-N |
| Mol Weight | 600.7 g/mol |
| Molecular Formula | C31H52O11 |
| Exact Mass | 600.350962 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2sLB1H2cKzC |
|---|---|
| Name | AURICULATOSIDE-B;PIMAR-15(16)-BETA-ENE-8-BETA,11-ALPHA-DIOL-20-(3-HYDROXY-3-METHYL)-BUTANOYL-7-BETA-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O11 |
| InChI | InChI=1S/C31H52O11/c1-7-29(6)12-17(33)25-30(16-40-21(34)13-28(4,5)38)10-8-9-27(2,3)19(30)11-20(31(25,39)15-29)42-26-24(37)23(36)22(35)18(14-32)41-26/h7,17-20,22-26,32-33,35-39H,1,8-16H2,2-6H3/t17-,18-,19+,20+,22-,23+,24-,25-,26+,29-,30-,31+/m1/s1 |
| InChIKey | QYIUUYJMNTUPAA-KVKTXYALSA-N |
| Literature Reference Author | W.CHANGZENG,Y.DEQUAN |
| Literature Reference Citation | PHYTOCHEM.,45,1483(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00156-8 |
| Molecular Weight | 600.747 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSP610 |