| SpectraBase Compound ID | 1V7LdiySCBn |
|---|---|
| InChI | InChI=1S/C41H56O19/c1-17-30(29(49)26-14-39(9)25-11-12-41(17,13-25)40(26,39)10)59-38-36(34(55-23(7)47)32(53-21(5)45)28(58-38)16-51-19(3)43)60-37-35(56-24(8)48)33(54-22(6)46)31(52-20(4)44)27(57-37)15-50-18(2)42/h17,25-28,30-38H,11-16H2,1-10H3/t17-,25+,26-,27-,28-,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40+,41+/m1/s1 |
| InChIKey | IXCRUDNJDDFLAL-URKFIUIHSA-N |
| Mol Weight | 852.9 g/mol |
| Molecular Formula | C41H56O19 |
| Exact Mass | 852.34158 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JqgthNaVOP2 |
|---|---|
| Name | 3-BETA-HYDROXY-SOLANASCONE-BETA-SOPHOROSIDE-HEPTAACETATE |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H56O19 |
| InChI | InChI=1S/C41H56O19/c1-17-30(29(49)26-14-39(9)25-11-12-41(17,13-25)40(26,39)10)59-38-36(34(55-23(7)47)32(53-21(5)45)28(58-38)16-51-19(3)43)60-37-35(56-24(8)48)33(54-22(6)46)31(52-20(4)44)27(57-37)15-50-18(2)42/h17,25-28,30-38H,11-16H2,1-10H3/t17-,25+,26-,27-,28-,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40+,41+/m1/s1 |
| InChIKey | IXCRUDNJDDFLAL-URKFIUIHSA-N |
| Literature Reference Author | H.KODAMA,T.FUJIMORI,K.KATO |
| Literature Reference Citation | AGR.BIOL.CHEM.,49,2537(1985) |
| Literature Reference DOI | 10.1271/bbb1961.49.2537 |
| Molecular Weight | 852.884 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWIR8475 |