| SpectraBase Compound ID | CtB94mTj9h0 |
|---|---|
| InChI | InChI=1S/C26H40O18/c27-4-8-3-11(9-1-2-38-23(14(8)9)44-25-20(36)18(34)16(32)12(5-28)41-25)40-26-21(37)22(17(33)13(6-29)42-26)43-24-19(35)15(31)10(30)7-39-24/h1-3,9-37H,4-7H2/t9-,10?,11+,12-,13-,14+,15?,16-,17-,18+,19?,20-,21-,22+,23-,24?,25+,26-/m0/s1 |
| InChIKey | QUZVTQBKZOPMMB-HCOABSIISA-N |
| Mol Weight | 640.6 g/mol |
| Molecular Formula | C26H40O18 |
| Exact Mass | 640.221464 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ETzbmTt54q |
|---|---|
| Name | SINUATOSIDE;6-O-SINUATOSYLAUCUBIN |
| Compound Number | 67 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H40O18 |
| InChI | InChI=1S/C26H40O18/c27-4-8-3-11(9-1-2-38-23(14(8)9)44-25-20(36)18(34)16(32)12(5-28)41-25)40-26-21(37)22(17(33)13(6-29)42-26)43-24-19(35)15(31)10(30)7-39-24/h1-3,9-37H,4-7H2/t9-,10?,11+,12-,13-,14+,15?,16-,17-,18+,19?,20-,21-,22+,23-,24?,25+,26-/m0/s1 |
| InChIKey | QUZVTQBKZOPMMB-HCOABSIISA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 640.593 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ16061 |