| SpectraBase Compound ID | 8Yg1WitgCko |
|---|---|
| InChI | InChI=1S/C29H40O17/c1-29(39)8-15(12-5-6-41-26(18(12)29)46-28-24(37)22(35)20(33)17(10-31)45-28)42-25(38)11-3-4-13(14(7-11)40-2)43-27-23(36)21(34)19(32)16(9-30)44-27/h3-7,12,15-24,26-28,30-37,39H,8-10H2,1-2H3/t12-,15+,16+,17-,18+,19+,20-,21-,22+,23+,24-,26-,27+,28+,29-/m0/s1 |
| InChIKey | WEDMMISOMZMEJJ-TYCFCVJSSA-N |
| Mol Weight | 660.6 g/mol |
| Molecular Formula | C29H40O17 |
| Exact Mass | 660.22655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 74beqNwrfnw |
|---|---|
| Name | REHMAGLUTOSIDE_B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H40O17 |
| InChI | InChI=1S/C29H40O17/c1-29(39)8-15(12-5-6-41-26(18(12)29)46-28-24(37)22(35)20(33)17(10-31)45-28)42-25(38)11-3-4-13(14(7-11)40-2)43-27-23(36)21(34)19(32)16(9-30)44-27/h3-7,12,15-24,26-28,30-37,39H,8-10H2,1-2H3/t12-,15+,16+,17-,18+,19+,20-,21-,22+,23+,24-,26-,27+,28+,29-/m0/s1 |
| InChIKey | WEDMMISOMZMEJJ-TYCFCVJSSA-N |
| Literature Reference Author | Y.F.LIU,D.LIANG,H.LUO,Z.Y.HAO,Y.WANG,C.L.ZHANG,Q.J.ZHANG,R.Y .CHEN,D.Q.YU |
| Literature Reference Citation | J.NAT.PROD.,75,1625(2012) |
| Literature Reference DOI | 10.1021/np300509z |
| Molecular Weight | 660.626 g/mol |
| Sample ID | 41459 |
| Solvent | CD3OD |