| SpectraBase Compound ID | 8AER7jOQbz6 |
|---|---|
| InChI | InChI=1S/C27H46O12/c1-12-4-6-15-14(8-27(15,2)3)13(5-7-16(12)29)10-36-25-24(35)22(33)20(31)18(39-25)11-37-26-23(34)21(32)19(30)17(9-28)38-26/h13-26,28-35H,1,4-11H2,2-3H3/t13-,14-,15-,16+,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-/m1/s1 |
| InChIKey | MYYDVMVPCJAUJA-MSPRJFAISA-N |
| Mol Weight | 562.7 g/mol |
| Molecular Formula | C27H46O12 |
| Exact Mass | 562.298927 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 17uPcHuuneN |
|---|---|
| Name | (1R,5R,8S,9S)-CARYOPHYLLA-4(15)-ENE-5,14-DIOL-14-O-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O12 |
| InChI | InChI=1S/C27H46O12/c1-12-4-6-15-14(8-27(15,2)3)13(5-7-16(12)29)10-36-25-24(35)22(33)20(31)18(39-25)11-37-26-23(34)21(32)19(30)17(9-28)38-26/h13-26,28-35H,1,4-11H2,2-3H3/t13-,14-,15-,16+,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-/m1/s1 |
| InChIKey | MYYDVMVPCJAUJA-MSPRJFAISA-N |
| Literature Reference Author | Y.ORIHARA,K.SAIKI,T.FURUYA |
| Literature Reference Citation | PHYTOCHEM.,35,635(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90577-6 |
| Molecular Weight | 562.655 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU24632 |