| SpectraBase Compound ID | KQO2v3JCoHA |
|---|---|
| InChI | InChI=1S/C32H40O17/c1-13-21(38)26(44-14(2)35)27(46-19(37)8-5-15-3-6-16(36)7-4-15)31(43-13)47-25-17-9-10-42-29(20(17)32(12-34)28(25)49-32)48-30-24(41)23(40)22(39)18(11-33)45-30/h3-10,13,17-18,20-31,33-34,36,38-41H,11-12H2,1-2H3/b8-5+/t13-,17-,18+,20-,21-,22+,23-,24+,25+,26+,27+,28+,29+,30-,31-,32-/m1/s1 |
| InChIKey | LHEWQIBORVAWFM-UCTJNKHGSA-N |
| Mol Weight | 696.7 g/mol |
| Molecular Formula | C32H40O17 |
| Exact Mass | 696.22655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LHQ2REJvil7 |
|---|---|
| Name | OREOSOLENOSIDE;E-ISOMER |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H40O17 |
| InChI | InChI=1S/C32H40O17/c1-13-21(38)26(44-14(2)35)27(46-19(37)8-5-15-3-6-16(36)7-4-15)31(43-13)47-25-17-9-10-42-29(20(17)32(12-34)28(25)49-32)48-30-24(41)23(40)22(39)18(11-33)45-30/h3-10,13,17-18,20-31,33-34,36,38-41H,11-12H2,1-2H3/b8-5+/t13-,17-,18+,20-,21-,22+,23-,24+,25+,26+,27+,28+,29+,30-,31-,32-/m1/s1 |
| InChIKey | LHEWQIBORVAWFM-UCTJNKHGSA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,R.BANIK |
| Literature Reference Citation | CHEM.PHARM.BULL.,59,803(2011) |
| Literature Reference DOI | 10.1248/cpb.59.803 |
| Molecular Weight | 696.659 g/mol |
| Source File Reference | UWIR3239 |