| SpectraBase Compound ID | 1kIR71OdSDk |
|---|---|
| InChI | InChI=1S/C40H54O25/c41-11-22-27(50)29(52)32(55)37(60-22)59-14-24-34(63-25(48)6-3-15-1-4-17(43)19(45)9-15)35(64-39-33(56)30(53)28(51)23(12-42)61-39)36(65-38-31(54)26(49)21(47)13-58-38)40(62-24)57-8-7-16-2-5-18(44)20(46)10-16/h1-6,9-10,21-24,26-47,49-56H,7-8,11-14H2/b6-3+/t21-,22+,23-,24-,26-,27+,28-,29-,30+,31+,32+,33-,34-,35+,36-,37+,38-,39+,40-/m1/s1 |
| InChIKey | UMOXPJPZSZQMQB-NPZDJVGHSA-N |
| Mol Weight | 934.8 g/mol |
| Molecular Formula | C40H54O25 |
| Exact Mass | 934.295417 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GMrzyBRuSK |
|---|---|
| Name | CHIONOSIDE-D;6'-O-BETA-GLUCOPYRANOSYL-ARAGOSIDE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H54O25 |
| InChI | InChI=1S/C40H54O25/c41-11-22-27(50)29(52)32(55)37(60-22)59-14-24-34(63-25(48)6-3-15-1-4-17(43)19(45)9-15)35(64-39-33(56)30(53)28(51)23(12-42)61-39)36(65-38-31(54)26(49)21(47)13-58-38)40(62-24)57-8-7-16-2-5-18(44)20(46)10-16/h1-6,9-10,21-24,26-47,49-56H,7-8,11-14H2/b6-3+/t21-,22+,23-,24-,26-,27+,28-,29-,30+,31+,32+,33-,34-,35+,36-,37+,38-,39+,40-/m1/s1 |
| InChIKey | UMOXPJPZSZQMQB-NPZDJVGHSA-N |
| Literature Reference Author | R.M.TASKOVA,T.KOKUBUN,K.G.RYAN,P.J.GARNOCK-JONES,S.R.JENSEN |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,703(2010) |
| Literature Reference DOI | 10.1248/cpb.58.703 |
| Molecular Weight | 934.854 g/mol |
| Source File Reference | UWBT3654 |