| SpectraBase Compound ID | 4p4qd4MYTC9 |
|---|---|
| InChI | InChI=1S/C27H46O12/c1-26(2)8-13-12(4-5-17-27(3,39-17)7-6-14(13)26)10-35-24-23(34)21(32)19(30)16(38-24)11-36-25-22(33)20(31)18(29)15(9-28)37-25/h12-25,28-34H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23-,24-,25-,27-/m1/s1 |
| InChIKey | TZYNELXDOMUHBB-AKGITYKZSA-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 | GWeAZcC4qIR |
|---|---|
| Name | (1R,4R,5R,8S,9S)-4,5-EPOXYCARYOPHYLLANE-14-OL-14-O-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O12 |
| InChI | InChI=1S/C27H46O12/c1-26(2)8-13-12(4-5-17-27(3,39-17)7-6-14(13)26)10-35-24-23(34)21(32)19(30)16(38-24)11-36-25-22(33)20(31)18(29)15(9-28)37-25/h12-25,28-34H,4-11H2,1-3H3/t12-,13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23-,24-,25-,27-/m1/s1 |
| InChIKey | TZYNELXDOMUHBB-AKGITYKZSA-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 | UWLU24633 |