SpectraBase Compound ID | 53cJXfJDdl4 |
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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 |
SpectraBase Spectrum ID | 5CRw7a9THH5 |
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Name | Soyasapogenol-B-triacetate |
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 = 400 MHz |
Literature Reference | Chem. Pharm. Bull. 35, 1610 (1987). |
NMR Standard | not reported |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |