| SpectraBase Compound ID | 1nfEVkPAXrj |
|---|---|
| InChI | InChI=1S/C32H52O15/c1-29(28(42)47-27-25(41)23(39)21(37)16(11-34)45-27)7-6-19(46-26-24(40)22(38)20(36)15(10-33)44-26)30(2)17(29)5-8-31-9-14(3-4-18(30)31)32(43,12-31)13-35/h14-27,33-41,43H,3-13H2,1-2H3/t14-,15+,16+,17-,18+,19+,20+,21+,22-,23-,24+,25+,26-,27-,29-,30-,31+,32+/m1/s1 |
| InChIKey | WFMUUUXXUIVMAH-NJUULXTMSA-N |
| Mol Weight | 676.8 g/mol |
| Molecular Formula | C32H52O15 |
| Exact Mass | 676.330621 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H94kvAs0mjI |
|---|---|
| Name | TRICALYSIOSIDE-Z;TRICALYSIOSIDE-H-19-O-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H52O15 |
| InChI | InChI=1S/C32H52O15/c1-29(28(42)47-27-25(41)23(39)21(37)16(11-34)45-27)7-6-19(46-26-24(40)22(38)20(36)15(10-33)44-26)30(2)17(29)5-8-31-9-14(3-4-18(30)31)32(43,12-31)13-35/h14-27,33-41,43H,3-13H2,1-2H3/t14-,15+,16+,17-,18+,19+,20+,21+,22-,23-,24+,25+,26-,27-,29-,30-,31+,32+/m1/s1 |
| InChIKey | WFMUUUXXUIVMAH-NJUULXTMSA-N |
| Literature Reference Author | J.SHITAMOTO,S.SUGIMOTO,K.MATSUNAMI,H.OTSUKA,T.SHINZATO,Y.TAK EDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,72(2011) |
| Literature Reference DOI | 10.1248/cpb.59.72 |
| Molecular Weight | 676.756 g/mol |
| Sample ID | 2625 |
| Solvent | C5D5N |