| SpectraBase Compound ID | 23Gd9VAIpWP |
|---|---|
| InChI | InChI=1S/C46H72O11/c1-13-24(3)38(52)55-34-26(5)54-40(33(50)35(34)56-39(53)25(4)14-2)57-37-36(51)46(23-47)28(21-41(37,6)7)27-15-16-30-43(10)19-18-31(48)42(8,9)29(43)17-20-44(30,11)45(27,12)22-32(46)49/h13-15,26,28-37,40,47-51H,16-23H2,1-12H3/b24-13-,25-14-/t26?,28-,29?,30?,31?,32-,33?,34?,35?,36-,37?,40?,43?,44?,45-,46-/m1/s1 |
| InChIKey | SBGLKLLWPJVDAZ-LSHNMLRESA-N |
| Mol Weight | 801.1 g/mol |
| Molecular Formula | C46H72O11 |
| Exact Mass | 800.507463 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EZbp3c3gxRt |
|---|---|
| Name | 21-O-(3,4-Di-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 | C46H72O11 |
| InChI | InChI=1S/C46H72O11/c1-13-24(3)38(52)55-34-26(5)54-40(33(50)35(34)56-39(53)25(4)14-2)57-37-36(51)46(23-47)28(21-41(37,6)7)27-15-16-30-43(10)19-18-31(48)42(8,9)29(43)17-20-44(30,11)45(27,12)22-32(46)49/h13-15,26,28-37,40,47-51H,16-23H2,1-12H3/b24-13-,25-14-/t26?,28-,29?,30?,31?,32-,33?,34?,35?,36-,37?,40?,43?,44?,45-,46-/m1/s1 |
| InChIKey | SBGLKLLWPJVDAZ-LSHNMLRESA-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 |