| SpectraBase Compound ID | GDnnO2IBAbe |
|---|---|
| InChI | InChI=1S/C42H68O13/c1-20-27(45)29(47)31(49)34(52-20)54-32-30(48)28(46)24(19-43)53-35(32)55-36(51)42-15-13-37(2,3)17-22(42)21-9-10-26-39(6)18-23(44)33(50)38(4,5)25(39)11-12-41(26,8)40(21,7)14-16-42/h9,20,22-35,43-50H,10-19H2,1-8H3/t20-,22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32+,33-,34-,35-,39-,40+,41+,42-/m0/s1 |
| InChIKey | JFXBJVIOGNUGKV-XTRMLDDRSA-N |
| Mol Weight | 781.0 g/mol |
| Molecular Formula | C42H68O13 |
| Exact Mass | 780.465992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6wPJ6fHS8Wx |
|---|---|
| Name | ASTERYUNNANOSIDE-C;2-ALPHA,3-BETA-DIHYDROXY-OLEAN-12-EN-28-OIC-ACID-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O13 |
| InChI | InChI=1S/C42H68O13/c1-20-27(45)29(47)31(49)34(52-20)54-32-30(48)28(46)24(19-43)53-35(32)55-36(51)42-15-13-37(2,3)17-22(42)21-9-10-26-39(6)18-23(44)33(50)38(4,5)25(39)11-12-41(26,8)40(21,7)14-16-42/h9,20,22-35,43-50H,10-19H2,1-8H3/t20-,22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32+,33-,34-,35-,39-,40+,41+,42-/m0/s1 |
| InChIKey | JFXBJVIOGNUGKV-XTRMLDDRSA-N |
| Literature Reference Author | Y.SHAO,B.N.ZHOU,L.Z.LIN,G.A.CORDELL |
| Literature Reference Citation | PHYTOCHEM.,38,1487(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00794-T |
| Molecular Weight | 780.994 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4066 |