| SpectraBase Compound ID | GQkbydofuM2 |
|---|---|
| InChI | InChI=1S/C28H42O8/c1-16-7-6-8-21-27(4,11-9-19-10-12-33-14-19)17(2)13-22(28(16,21)5)36-26-25(32)24(31)23(30)20(35-26)15-34-18(3)29/h7,10,12,14,17,20-26,30-32H,6,8-9,11,13,15H2,1-5H3/t17-,20+,21-,22+,23+,24-,25+,26-,27+,28+/m1/s1 |
| InChIKey | YJFUPLDNQJPTTQ-CZBQMDJLSA-N |
| Mol Weight | 506.6 g/mol |
| Molecular Formula | C28H42O8 |
| Exact Mass | 506.287968 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6uzgpBOA9WA |
|---|---|
| Name | SALVIGRESIDE-D;6-ALPHA-O-(6-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-15,16-EPOXY-CLERODA-3,13(16),14-TRIEN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O8 |
| InChI | InChI=1S/C28H42O8/c1-16-7-6-8-21-27(4,11-9-19-10-12-33-14-19)17(2)13-22(28(16,21)5)36-26-25(32)24(31)23(30)20(35-26)15-34-18(3)29/h7,10,12,14,17,20-26,30-32H,6,8-9,11,13,15H2,1-5H3/t17-,20+,21-,22+,23+,24-,25+,26-,27+,28+/m1/s1 |
| InChIKey | YJFUPLDNQJPTTQ-CZBQMDJLSA-N |
| Literature Reference Author | N.KAWAHARA,T.TAMURA,M.INOUE,T.HOSOE,K.I.KAWAI,S.SEKITA,M.SAT AKE,Y.GODA |
| Literature Reference Citation | PHYTOCHEM.,65,2577(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.08.012 |
| Molecular Weight | 506.637 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU32960 |