Dioscin
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 3TBj50Ybk6y |
|---|---|
| InChI | InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(34(50)32(48)29(17-46)58-42)60-41-37(53)35(51)38(22(4)56-41)59-40-36(52)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19?,20?,21-,22-,24?,25?,26?,27?,28?,29?,30?,31-,32?,33-,34?,35+,36+,37+,38-,39?,40-,41+,42?,43?,44?,45?/m0/s1 |
| InChIKey | HHNXENJXGVOLKE-PSRADYOESA-N |
| Mol Weight | 869.1 g/mol |
| Molecular Formula | C45H72O16 |
| Exact Mass | 868.482036 g/mol |
| Enantiomer InChIKey | HHNXENJXGVOLKE-NGIADSNBSA-N |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | Pyridine-D5 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.
NIST/EPA/NIH MS/MS Mass Spectral Library 2020 LR
Author: NIST
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.
NIST/EPA/NIH MS/MS Mass Spectral Library 2020 HR
Author: NIST
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.