| SpectraBase Compound ID | D1xevp37Xfc |
|---|---|
| InChI | InChI=1S/C25H30O14/c1-35-23(34)16-11-37-24(39-25-22(33)21(32)20(31)17(10-26)38-25)15(14(16)8-18(28)29)9-19(30)36-7-6-12-2-4-13(27)5-3-12/h2-5,9,11,14,17,20-22,24-27,31-33H,6-8,10H2,1H3,(H,28,29)/b15-9+/t14-,17-,20-,21+,22-,24-,25+/m0/s1 |
| InChIKey | BSVGPPPZJUYLEA-LFFJPWSWSA-N |
| Mol Weight | 554.5 g/mol |
| Molecular Formula | C25H30O14 |
| Exact Mass | 554.163556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 70dpbjabvT9 |
|---|---|
| Name | ISOLIGUSTROSIDIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O14 |
| InChI | InChI=1S/C25H30O14/c1-35-23(34)16-11-37-24(39-25-22(33)21(32)20(31)17(10-26)38-25)15(14(16)8-18(28)29)9-19(30)36-7-6-12-2-4-13(27)5-3-12/h2-5,9,11,14,17,20-22,24-27,31-33H,6-8,10H2,1H3,(H,28,29)/b15-9+/t14-,17-,20-,21+,22-,24-,25+/m0/s1 |
| InChIKey | BSVGPPPZJUYLEA-LFFJPWSWSA-N |
| Literature Reference Author | S.AOKI,Y.HONDA,T.KIKUCHI,T.MIURA,R.SUGAWARA,Y.YAOITA,M.KIKUC HI,K.MACHIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,60,251(2012) |
| Literature Reference DOI | 10.1248/cpb.60.251 |
| Molecular Weight | 554.505 g/mol |
| Source File Reference | UWBT4281 |