| SpectraBase Compound ID | 5SzSNJ8zSul |
|---|---|
| InChI | InChI=1S/C32H38O18/c1-43-15-4-2-14(3-5-15)17-8-44-19-7-16(6-18(34)21(19)22(17)35)49-28-25(38)24(37)23(36)20(50-28)9-45-29-27(40)32(42,12-47-29)13-48-30-26(39)31(41,10-33)11-46-30/h2-8,20,23-30,33-34,36-42H,9-13H2,1H3/t20-,23-,24+,25-,26+,27+,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | CKLMBUIIPNQRLI-DJSJNSIOSA-N |
| Mol Weight | 710.6 g/mol |
| Molecular Formula | C32H38O18 |
| Exact Mass | 710.205814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zqu2VGaR7K |
|---|---|
| Name | BIOCHANIN-A-7-O-[BETA-D-APIOFURANOSYL-(1->5)-BETA-D-APIOFURANOSYL-(1->6)-BETA-GLUCOPYRANOSIDE] |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H38O18 |
| InChI | InChI=1S/C32H38O18/c1-43-15-4-2-14(3-5-15)17-8-44-19-7-16(6-18(34)21(19)22(17)35)49-28-25(38)24(37)23(36)20(50-28)9-45-29-27(40)32(42,12-47-29)13-48-30-26(39)31(41,10-33)11-46-30/h2-8,20,23-30,33-34,36-42H,9-13H2,1H3/t20-,23-,24+,25-,26+,27+,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | CKLMBUIIPNQRLI-DJSJNSIOSA-N |
| Literature Reference Author | S.F.FARAG,A.S.AHMED,K.TERASHIMA,Y.TAKAYA,M.NIWA |
| Literature Reference Citation | PHYTOCHEM.,57,1263(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00195-9 |
| Molecular Weight | 710.643 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN2448 |