| SpectraBase Compound ID | 6YOcXsxWBns |
|---|---|
| InChI | InChI=1S/2C34H24O22/c2*35-10-1-6-15(23(43)19(10)39)16-7(2-11(36)20(40)24(16)44)31(48)54-27-14(5-52-30(6)47)53-34(51)29-28(27)55-32(49)8-3-12(37)21(41)25(45)17(8)18-9(33(50)56-29)4-13(38)22(42)26(18)46/h2*1-4,14,27-29,34-46,51H,5H2/t14-,27-,28+,29-,34+;14-,27-,28+,29-,34-/m11/s1 |
| InChIKey | VTRZJYADPICHRI-XPSCTZNQSA-N |
| Mol Weight | 1569.1 g/mol |
| Molecular Formula | C68H48O44 |
| Exact Mass | 1568.151845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LggFYdp7DPg |
|---|---|
| Name | BIS-2,3;4,6-HEXAHYDROXY-DIPHENOYL-ALPHA/BETA-GLUCOPYRANOSIDE;PEDUNCULAGIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H48O44 |
| InChI | InChI=1S/2C34H24O22/c2*35-10-1-6-15(23(43)19(10)39)16-7(2-11(36)20(40)24(16)44)31(48)54-27-14(5-52-30(6)47)53-34(51)29-28(27)55-32(49)8-3-12(37)21(41)25(45)17(8)18-9(33(50)56-29)4-13(38)22(42)26(18)46/h2*1-4,14,27-29,34-46,51H,5H2/t14-,27-,28+,29-,34+;14-,27-,28+,29-,34-/m11/s1 |
| InChIKey | VTRZJYADPICHRI-XPSCTZNQSA-N |
| Literature Reference Author | S.A.M.HUSSEIN,N.A.AYOUB,M.A.M.NAWWAR |
| Literature Reference Citation | PHYTOCHEM.,63,905(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00331-5 |
| Molecular Weight | 1569.103 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS28422 |