| SpectraBase Compound ID | DcGXh7hLgPA |
|---|---|
| InChI | InChI=1S/C41H68O16/c1-18-27(43)34(50-6)31(47)38(52-18)55-22-10-13-39(4)21(16-22)8-9-23-24(39)11-14-40(5)25(23)12-15-41(40,49)20(3)54-37-32(48)35(51-7)33(19(2)53-37)57-36-30(46)29(45)28(44)26(17-42)56-36/h8-9,18-38,42-49H,10-17H2,1-7H3/t18-,19+,20-,21+,22+,23-,24+,25+,26+,27+,28+,29-,30+,31-,32+,33-,34+,35+,36-,37-,38+,39+,40+,41+/m1/s1 |
| InChIKey | MLGQBHZZBXTFTQ-CZQXRSRQSA-N |
| Mol Weight | 817.0 g/mol |
| Molecular Formula | C41H68O16 |
| Exact Mass | 816.450736 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KvSHznepbN4 |
|---|---|
| Name | TEIKAGENIN-3-O-BETA-D-DIGITALOSYL-20-O-BETA-D-GLUCOSYL-(1->4)-BETA-D-DIGITALOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H68O16 |
| InChI | InChI=1S/C41H68O16/c1-18-27(43)34(50-6)31(47)38(52-18)55-22-10-13-39(4)21(16-22)8-9-23-24(39)11-14-40(5)25(23)12-15-41(40,49)20(3)54-37-32(48)35(51-7)33(19(2)53-37)57-36-30(46)29(45)28(44)26(17-42)56-36/h8-9,18-38,42-49H,10-17H2,1-7H3/t18-,19+,20-,21+,22+,23-,24+,25+,26+,27+,28+,29-,30+,31-,32+,33-,34+,35+,36-,37-,38+,39+,40+,41+/m1/s1 |
| InChIKey | MLGQBHZZBXTFTQ-CZQXRSRQSA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,37,33(1989) |
| Literature Reference DOI | 10.1248/cpb.37.33 |
| Molecular Weight | 816.981 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK1013 |