SpectraBase Compound ID | CkgV6FuiR3p |
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InChI | InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25?,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1 |
InChIKey | LTMHDMANZUZIPE-YUICGFAKSA-N |
Mol Weight | 780.9 g/mol |
Molecular Formula | C41H64O14 |
Exact Mass | 780.429607 g/mol |
SpectraBase Spectrum ID | Hw7KHrY7fnU |
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Name | Digoxin |
Source of Sample | Sigma-Aldrich Company Llc. |
Catalog Number | D6003 |
Lot Number | 078K1217 |
CAS Registry Number | 20830-75-5 |
Copyright | Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C41H64O14 |
InChI | InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25?,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1 |
InChIKey | LTMHDMANZUZIPE-YUICGFAKSA-N |
Raman Corrections | Referenced to internal white light source; 180 Degree backscatter |
Raman Laser Source | Nd:YAG |
Sadtler IR Number | DW0362 |
Source of Spectrum | Forensic Spectral Research |
Synonyms | Card-20(22)-enolide, 3-((O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-12,14-dihydroxy-, (3beta,5beta,12beta)- |
Technique | FT-Raman |