| SpectraBase Compound ID | DshV2hxAc3s |
|---|---|
| InChI | InChI=1S/C36H56O13/c1-17-8-11-35(30(46)49-28-25(42)24(41)23(40)20(15-37)48-28)13-12-32(3)18(26(35)34(17,5)47)6-7-21-31(2)14-19(39)27(43)36(16-38,29(44)45)22(31)9-10-33(21,32)4/h6,17,19-28,37-43,47H,7-16H2,1-5H3,(H,44,45)/t17-,19-,20-,21?,22?,23-,24+,25-,26?,27+,28+,31-,32-,33-,34-,35+,36+/m1/s1 |
| InChIKey | CFDNGAGSXAPVLK-BXAOCZMISA-N |
| Mol Weight | 696.8 g/mol |
| Molecular Formula | C36H56O13 |
| Exact Mass | 696.372092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GreGAVIKUOM |
|---|---|
| Name | TRACHELOSPEROSIDE-C-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56O13 |
| InChI | InChI=1S/C36H56O13/c1-17-8-11-35(30(46)49-28-25(42)24(41)23(40)20(15-37)48-28)13-12-32(3)18(26(35)34(17,5)47)6-7-21-31(2)14-19(39)27(43)36(16-38,29(44)45)22(31)9-10-33(21,32)4/h6,17,19-28,37-43,47H,7-16H2,1-5H3,(H,44,45)/t17-,19-,20-,21?,22?,23-,24+,25-,26?,27+,28+,31-,32-,33-,34-,35+,36+/m1/s1 |
| InChIKey | CFDNGAGSXAPVLK-BXAOCZMISA-N |
| Literature Reference Author | F.ABE,T.YAMAUCHI |
| Literature Reference Citation | CHEM.PHARM.BULL.,35,1748(1987) |
| Literature Reference DOI | 10.1248/cpb.35.1748 |
| Molecular Weight | 696.833 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK106 |