| SpectraBase Compound ID | BDxYjCFA7cb |
|---|---|
| InChI | InChI=1S/C46H70O18/c1-20-25(12-13-56-20)26-10-11-28-27(38(26)50)9-8-24-14-31(30(49)18-46(24,28)5)60-36-16-32(54-6)43(22(3)58-36)63-35-15-29(48)42(21(2)57-35)62-37-17-33(55-7)44(23(4)59-37)64-45-41(53)40(52)39(51)34(19-47)61-45/h8,12-13,21-23,26-37,39-45,47-49,51-53H,9-11,14-19H2,1-7H3/t21-,22-,23+,26+,27+,28-,29+,30+,31+,32+,33-,34+,35+,36+,37+,39+,40-,41+,42-,43-,44+,45-,46-/m0/s1 |
| InChIKey | LXQUMKIZBPMPDF-XKXZDIMCSA-N |
| Mol Weight | 911.0 g/mol |
| Molecular Formula | C46H70O18 |
| Exact Mass | 910.456215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ntxwh992FW |
|---|---|
| Name | CYNASCYROSIDE-C |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H70O18 |
| InChI | InChI=1S/C46H70O18/c1-20-25(12-13-56-20)26-10-11-28-27(38(26)50)9-8-24-14-31(30(49)18-46(24,28)5)60-36-16-32(54-6)43(22(3)58-36)63-35-15-29(48)42(21(2)57-35)62-37-17-33(55-7)44(23(4)59-37)64-45-41(53)40(52)39(51)34(19-47)61-45/h8,12-13,21-23,26-37,39-45,47-49,51-53H,9-11,14-19H2,1-7H3/t21-,22-,23+,26+,27+,28-,29+,30+,31+,32+,33-,34+,35+,36+,37+,39+,40-,41+,42-,43-,44+,45-,46-/m0/s1 |
| InChIKey | LXQUMKIZBPMPDF-XKXZDIMCSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1551(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1551 |
| Molecular Weight | 911.051 g/mol |
| Sample ID | 55379 |
| Solvent | C5D5N |