| SpectraBase Compound ID | B1cTO5fTmDv |
|---|---|
| InChI | InChI=1S/C49H78O15/c1-25(2)26(3)19-39(51)62-38-24-37-46(8)16-14-32(20-31(46)13-17-48(37,53)49(54)18-15-33(27(4)50)47(38,49)9)61-40-22-35(56-11)44(29(6)59-40)64-42-23-36(57-12)45(30(7)60-42)63-41-21-34(55-10)43(52)28(5)58-41/h13,19,25,28-30,32-38,40-45,52-54H,14-18,20-24H2,1-12H3/b26-19+/t28-,29-,30+,32+,33+,34+,35+,36-,37-,38-,40+,41+,42-,43-,44-,45+,46+,47+,48+,49-/m1/s1 |
| InChIKey | DNOLGGAOXNIEOS-CODCVSALSA-N |
| Mol Weight | 907.1 g/mol |
| Molecular Formula | C49H78O15 |
| Exact Mass | 906.534072 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6uVz3ETuv9G |
|---|---|
| Name | CYNANCHOGENIN-3-O-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H78O15 |
| InChI | InChI=1S/C49H78O15/c1-25(2)26(3)19-39(51)62-38-24-37-46(8)16-14-32(20-31(46)13-17-48(37,53)49(54)18-15-33(27(4)50)47(38,49)9)61-40-22-35(56-11)44(29(6)59-40)64-42-23-36(57-12)45(30(7)60-42)63-41-21-34(55-10)43(52)28(5)58-41/h13,19,25,28-30,32-38,40-45,52-54H,14-18,20-24H2,1-12H3/b26-19+/t28-,29-,30+,32+,33+,34+,35+,36-,37-,38-,40+,41+,42-,43-,44-,45+,46+,47+,48+,49-/m1/s1 |
| InChIKey | DNOLGGAOXNIEOS-CODCVSALSA-N |
| Literature Reference Author | K.WADA,K.HAYASHI,H.MITSUHASHI,H.BANDO |
| Literature Reference Citation | CHEM.PHARM.BULL.,30,3500(1982) |
| Literature Reference DOI | 10.1248/cpb.30.3500 |
| Molecular Weight | 907.149 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK1094 |