| SpectraBase Compound ID | A6UkvgBi2ZC |
|---|---|
| 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-PHLHSBBHSA-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 | 7arNFqCY3Lx |
|---|---|
| Name | 21-O-(4-O-Acetyl-3-O-angeloyl).beta.-D-fucopyranosyl-theasapogenol-B |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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-PHLHSBBHSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Chem. Pharm. Bull. 33, 127 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |