| SpectraBase Compound ID | JUX0Xhh7ZQL |
|---|---|
| InChI | InChI=1S/C28H50O15/c1-12-25(15(33-4)8-19(36-7)37-12)41-20-9-16(34-5)26(13(2)38-20)42-21-10-17(35-6)27(14(3)39-21)43-28-24(32)23(31)22(30)18(11-29)40-28/h12-32H,8-11H2,1-7H3/t12-,13-,14-,15+,16+,17-,18-,19+,20+,21+,22-,23+,24-,25-,26-,27+,28+/m0/s1 |
| InChIKey | SAJBKANAQBEAJE-BDMYWRFGSA-N |
| Mol Weight | 626.7 g/mol |
| Molecular Formula | C28H50O15 |
| Exact Mass | 626.314971 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lle4p3gnCRq |
|---|---|
| Name | ADOLIGOSE-B;BETA-GLUCOPYRANOSYL-(1->4)-O-BETA-DIGINOPYRANOSYL-(1->4)-O-BETA-CYMAROPYRANOSYL-(1->4)-O-ALPHA-CYMAROSE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H50O15 |
| InChI | InChI=1S/C28H50O15/c1-12-25(15(33-4)8-19(36-7)37-12)41-20-9-16(34-5)26(13(2)38-20)42-21-10-17(35-6)27(14(3)39-21)43-28-24(32)23(31)22(30)18(11-29)40-28/h12-32H,8-11H2,1-7H3/t12-,13-,14-,15+,16+,17-,18-,19+,20+,21+,22-,23+,24-,25-,26-,27+,28+/m0/s1 |
| InChIKey | SAJBKANAQBEAJE-BDMYWRFGSA-N |
| Literature Reference Author | G.F.PAULI |
| Literature Reference Citation | J.NAT.PROD.,58,483(1995) |
| Literature Reference DOI | 10.1021/np50118a002 |
| Molecular Weight | 626.696 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP4062 |