| SpectraBase Compound ID | 7Lly7rDtKMG |
|---|---|
| InChI | InChI=1S/C43H72O15/c1-20(9-10-27(48)39(5,6)53)29-22(46)16-41(8)26-15-24(56-36-33(52)32(51)31(50)25(17-44)57-36)35-38(3,4)28(11-12-43(35)19-42(26,43)14-13-40(29,41)7)58-37-34(55-21(2)45)30(49)23(47)18-54-37/h20,22-37,44,46-53H,9-19H2,1-8H3/t20-,22+,23-,24+,25+,26+,27-,28+,29+,30+,31+,32-,33+,34-,35+,36+,37+,40-,41+,42+,43-/m1/s1 |
| InChIKey | QXBGJYSVZHVPMA-KXFIFEKQSA-N |
| Mol Weight | 829.0 g/mol |
| Molecular Formula | C43H72O15 |
| Exact Mass | 828.487122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4cHsWtRsBel |
|---|---|
| Name | AGROASTRAGALOSIDE-II;#4;3-O-BETA-(2'-O-ACETYL)-D-XYLOPYRANOSYL-6-O-BETA-D-GLUCOPYRANOSYL-(24S)-3-BETA,6-ALPHA,16-BETA,24,25-PENTAHYDROXY-9,19-CYCLOLANOSTANE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H72O15 |
| InChI | InChI=1S/C43H72O15/c1-20(9-10-27(48)39(5,6)53)29-22(46)16-41(8)26-15-24(56-36-33(52)32(51)31(50)25(17-44)57-36)35-38(3,4)28(11-12-43(35)19-42(26,43)14-13-40(29,41)7)58-37-34(55-21(2)45)30(49)23(47)18-54-37/h20,22-37,44,46-53H,9-19H2,1-8H3/t20-,22+,23-,24+,25+,26+,27-,28+,29+,30+,31+,32-,33+,34-,35+,36+,37+,40-,41+,42+,43-/m1/s1 |
| InChIKey | QXBGJYSVZHVPMA-KXFIFEKQSA-N |
| Literature Reference Author | M.HIROTANI,Y.ZHOU,H.RUI,T.FURUYA |
| Literature Reference Citation | PHYTOCHEM.,37,1403(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90420-5 |
| Molecular Weight | 829.036 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS23591 |