| SpectraBase Compound ID | GY2Kw3p9MH8 |
|---|---|
| InChI | InChI=1S/C43H68O11/c1-12-22(2)36(50)53-33-31(48)37(51-23(3)32(33)52-24(4)45)54-35-34(49)43(21-44)26(19-38(35,5)6)25-13-14-28-40(9)17-16-29(46)39(7,8)27(40)15-18-41(28,10)42(25,11)20-30(43)47/h12-13,23,26-35,37,44,46-49H,14-21H2,1-11H3/b22-12-/t23-,26?,27?,28?,29+,30-,31-,32+,33-,34+,35+,37+,40+,41-,42-,43+/m1/s1 |
| InChIKey | SWNPUFVYNZDULN-XETVVDTMSA-N |
| Mol Weight | 761.0 g/mol |
| Molecular Formula | C43H68O11 |
| Exact Mass | 760.476163 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5OpbDK3pgfG |
|---|---|
| Name | 21-O-(4-O-ACETYL-3-O-ANGELOYL)-BETA-D-FUCOPYRANOSYL-THEASAPOGENOL-B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O11 |
| InChI | InChI=1S/C43H68O11/c1-12-22(2)36(50)53-33-31(48)37(51-23(3)32(33)52-24(4)45)54-35-34(49)43(21-44)26(19-38(35,5)6)25-13-14-28-40(9)17-16-29(46)39(7,8)27(40)15-18-41(28,10)42(25,11)20-30(43)47/h12-13,23,26-35,37,44,46-49H,14-21H2,1-11H3/b22-12-/t23-,26?,27?,28?,29+,30-,31-,32+,33-,34+,35+,37+,40+,41-,42-,43+/m1/s1 |
| InChIKey | SWNPUFVYNZDULN-XETVVDTMSA-N |
| Literature Reference Author | Y.CHEN,T.TAKEDA,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,127(1985) |
| Literature Reference DOI | 10.1248/cpb.33.127 |
| Molecular Weight | 761.006 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK188 |