| SpectraBase Compound ID | 7YEodMV2zTU |
|---|---|
| InChI | InChI=1S/C40H44O21/c1-15-25(44)31(50)36(61-39-33(52)30(49)27(46)23(59-39)14-54-37(53)17-5-3-2-4-6-17)40(55-15)56-19-11-20(43)24-21(12-19)57-34(16-7-9-18(42)10-8-16)35(28(24)47)60-38-32(51)29(48)26(45)22(13-41)58-38/h2-12,15,22-23,25-27,29-33,36,38-46,48-52H,13-14H2,1H3/t15-,22-,23+,25-,26-,27+,29+,30-,31+,32-,33+,36+,38+,39?,40-/m0/s1 |
| InChIKey | HBKXVPBTWWQREN-WDZNLZCVSA-N |
| Mol Weight | 860.8 g/mol |
| Molecular Formula | C40H44O21 |
| Exact Mass | 860.237508 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FvGab8fWYUu |
|---|---|
| Name | KAEMPFEROL_3-O-BETA-GLUCOPYRANOSIDE-7-O-(6-BENZOYL)-BETA-GLUCOPYRANOSYL-(1->2)-ALPHA-RHAMNOPYRANOSIDE;CHIIRIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H44O21 |
| InChI | InChI=1S/C40H44O21/c1-15-25(44)31(50)36(61-39-33(52)30(49)27(46)23(59-39)14-54-37(53)17-5-3-2-4-6-17)40(55-15)56-19-11-20(43)24-21(12-19)57-34(16-7-9-18(42)10-8-16)35(28(24)47)60-38-32(51)29(48)26(45)22(13-41)58-38/h2-12,15,22-23,25-27,29-33,36,38-46,48-52H,13-14H2,1H3/t15-,22-,23+,25-,26-,27+,29+,30-,31+,32-,33+,36+,38+,39?,40-/m0/s1 |
| InChIKey | HBKXVPBTWWQREN-WDZNLZCVSA-N |
| Literature Reference Author | H.J.JEONG,W.K.WHANG,I.H.KIM |
| Literature Reference Citation | PLANTA.MED.,63,329(1997) |
| Literature Reference DOI | 10.1055/s-2006-957694 |
| Molecular Weight | 860.777 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UIAP955 |