| SpectraBase Compound ID | LjDBQ1JQ7Hb |
|---|---|
| InChI | InChI=1S/C42H68O14/c1-37(2)12-14-42(36(52)56-35-32(30(49)28(47)24(19-44)54-35)55-34-31(50)29(48)27(46)23(18-43)53-34)15-13-40(6)20(21(42)16-37)8-9-26-39(5)17-22(45)33(51)38(3,4)25(39)10-11-41(26,40)7/h8,21-35,43-51H,9-19H2,1-7H3/t21-,22+,23+,24+,25-,26+,27+,28+,29-,30-,31+,32+,33-,34-,35-,39-,40+,41+,42-/m0/s1 |
| InChIKey | JPEOIYBEGJTJCG-XILXIOJASA-N |
| Mol Weight | 797.0 g/mol |
| Molecular Formula | C42H68O14 |
| Exact Mass | 796.460907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HPcBCxKXPKU |
|---|---|
| Name | ASTERYUNNANOSIDE-D;2-ALPHA,3-BETA-DIHYDROXY-OLEAN-12-EN-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H68O14 |
| InChI | InChI=1S/C42H68O14/c1-37(2)12-14-42(36(52)56-35-32(30(49)28(47)24(19-44)54-35)55-34-31(50)29(48)27(46)23(18-43)53-34)15-13-40(6)20(21(42)16-37)8-9-26-39(5)17-22(45)33(51)38(3,4)25(39)10-11-41(26,40)7/h8,21-35,43-51H,9-19H2,1-7H3/t21-,22+,23+,24+,25-,26+,27+,28+,29-,30-,31+,32+,33-,34-,35-,39-,40+,41+,42-/m0/s1 |
| InChIKey | JPEOIYBEGJTJCG-XILXIOJASA-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 | 796.994 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4067 |