| SpectraBase Compound ID | 8RphyjwtrW5 |
|---|---|
| InChI | InChI=1S/C36H58O8/c1-20-26(39)27(40)28(41)29(43-20)44-25-10-11-31(4)21(32(25,5)18-37)8-12-33(6)22(31)9-13-36-23-16-30(2,3)14-15-35(23,19-42-36)24(38)17-34(33,36)7/h9,13,20-29,37-41H,8,10-12,14-19H2,1-7H3/t20?,21?,22-,23+,24-,25?,26?,27?,28?,29?,31?,32?,33-,34+,35+,36-/m1/s1 |
| InChIKey | WSSVJIGMYVWUJL-YIMSUUTBSA-N |
| Mol Weight | 618.9 g/mol |
| Molecular Formula | C36H58O8 |
| Exact Mass | 618.413169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gt1F9zBvl8c |
|---|---|
| Name | Prosaikogenin-F |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H58O8 |
| InChI | InChI=1S/C36H58O8/c1-20-26(39)27(40)28(41)29(43-20)44-25-10-11-31(4)21(32(25,5)18-37)8-12-33(6)22(31)9-13-36-23-16-30(2,3)14-15-35(23,19-42-36)24(38)17-34(33,36)7/h9,13,20-29,37-41H,8,10-12,14-19H2,1-7H3/t20?,21?,22-,23+,24-,25?,26?,27?,28?,29?,31?,32?,33-,34+,35+,36-/m1/s1 |
| InChIKey | WSSVJIGMYVWUJL-YIMSUUTBSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Chem. Pharm. Bull. 33, 3349 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |