| SpectraBase Compound ID | 53cJXfJDdl4 |
|---|---|
| InChI | InChI=1S/C36H56O6/c1-22(37)40-21-34(8)27-13-16-36(10)28(33(27,7)15-14-29(34)41-23(2)38)12-11-25-26-19-31(4,5)20-30(42-24(3)39)32(26,6)17-18-35(25,36)9/h11,26-30H,12-21H2,1-10H3/t26-,27?,28?,29?,30-,32+,33?,34?,35+,36?/m1/s1 |
| InChIKey | BMZLRBQUZRSCCU-OOVJCTBNSA-N |
| Mol Weight | 584.8 g/mol |
| Molecular Formula | C36H56O6 |
| Exact Mass | 584.40769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9U4w13IyKFT |
|---|---|
| Name | Soyasapogenol-B-acetate |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H56O6 |
| InChI | InChI=1S/C36H56O6/c1-22(37)40-21-34(8)27-13-16-36(10)28(33(27,7)15-14-29(34)41-23(2)38)12-11-25-26-19-31(4,5)20-30(42-24(3)39)32(26,6)17-18-35(25,36)9/h11,26-30H,12-21H2,1-10H3/t26-,27?,28?,29?,30-,32+,33?,34?,35+,36?/m1/s1 |
| InChIKey | BMZLRBQUZRSCCU-OOVJCTBNSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | J. Nat. Products 51, 335 (1988). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |