| SpectraBase Compound ID | KWGueFWQ8pR |
|---|---|
| InChI | InChI=1S/C42H50O22/c1-18-30(61-38(50)26-12-10-9-11-13-26)33(56-22(5)46)35(58-24(7)48)40(54-18)62-31-27-14-15-51-39(29(27)42(37(31)64-42)17-53-20(3)44)63-41-36(59-25(8)49)34(57-23(6)47)32(55-21(4)45)28(60-41)16-52-19(2)43/h9-15,18,27-37,39-41H,16-17H2,1-8H3/t18-,27-,28+,29-,30-,31+,32+,33+,34-,35+,36+,37+,39+,40-,41-,42-/m1/s1 |
| InChIKey | GGDHHLBMQOUSNN-WEURJYIQSA-N |
| Mol Weight | 906.8 g/mol |
| Molecular Formula | C42H50O22 |
| Exact Mass | 906.279373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LJmV2OXG60i |
|---|---|
| Name | 6-O-(3''-O-BENZOYL)-ALPHA-L-RHAMNOPYRANOSYL-CATALPOL-PERACETYLATED |
| Compound Number | 28 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H50O22 |
| InChI | InChI=1S/C42H50O22/c1-18-30(61-38(50)26-12-10-9-11-13-26)33(56-22(5)46)35(58-24(7)48)40(54-18)62-31-27-14-15-51-39(29(27)42(37(31)64-42)17-53-20(3)44)63-41-36(59-25(8)49)34(57-23(6)47)32(55-21(4)45)28(60-41)16-52-19(2)43/h9-15,18,27-37,39-41H,16-17H2,1-8H3/t18-,27-,28+,29-,30-,31+,32+,33+,34-,35+,36+,37+,39+,40-,41-,42-/m1/s1 |
| InChIKey | GGDHHLBMQOUSNN-WEURJYIQSA-N |
| Literature Reference Author | B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,765(2009) |
| Literature Reference DOI | 10.1248/cpb.57.765 |
| Molecular Weight | 906.846 g/mol |
| Sample ID | 2628 |
| Solvent | CDCl3 |