| SpectraBase Compound ID | 5GShA85K6n6 |
|---|---|
| InChI | InChI=1S/C44H74O15/c1-21(2)11-10-14-44(9,59-39-36(54)33(51)31(49)26(19-45)57-39)23-12-16-42(7)30(23)24(47)17-28-41(6)15-13-29(48)40(4,5)37(41)25(18-43(28,42)8)56-38-35(53)34(52)32(50)27(58-38)20-55-22(3)46/h11,23-39,45,47-54H,10,12-20H2,1-9H3/t23-,24+,25-,26+,27+,28?,29-,30-,31+,32+,33-,34-,35+,36+,37?,38+,39-,41+,42+,43+,44-/m0/s1 |
| InChIKey | YDCUKUFFVMOSKZ-CAKXVYRKSA-N |
| Mol Weight | 843.1 g/mol |
| Molecular Formula | C44H74O15 |
| Exact Mass | 842.502772 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ExSAXwGbTF6 |
|---|---|
| Name | 6'-O-ACETYL_GINSENOSIDE_RG1 |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74O15 |
| InChI | InChI=1S/C44H74O15/c1-21(2)11-10-14-44(9,59-39-36(54)33(51)31(49)26(19-45)57-39)23-12-16-42(7)30(23)24(47)17-28-41(6)15-13-29(48)40(4,5)37(41)25(18-43(28,42)8)56-38-35(53)34(52)32(50)27(58-38)20-55-22(3)46/h11,23-39,45,47-54H,10,12-20H2,1-9H3/t23-,24+,25-,26+,27+,28?,29-,30-,31+,32+,33-,34-,35+,36+,37?,38+,39-,41+,42+,43+,44-/m0/s1 |
| InChIKey | YDCUKUFFVMOSKZ-CAKXVYRKSA-N |
| Literature Reference Author | B.DANIELI,M.LUISETTI,S.RIVA,A.BERTINOTTI,E.RAGG,L.SCAGLIONI, E.BOMBARDELLI |
| Literature Reference Citation | J.ORG.CHEM.,60,3637(1995) |
| Literature Reference DOI | 10.1021/jo00117a012 |
| Molecular Weight | 843.063 g/mol |
| Solvent | DMSO-D6:D2O |
| Source File Reference | UWMZ2321 |