| SpectraBase Compound ID | BVJ3atHo1NM |
|---|---|
| InChI | InChI=1S/C39H48O10/c1-11-20(3)34(42)47-31-28-27(37(28,9)10)30(45-25(8)40)24(7)32(41)38-19-23(6)33(48-35(43)21(4)12-2)39(38,49-38)18-22(5)29(31)46-36(44)26-16-14-13-15-17-26/h11-18,23-24,27-31,33H,19H2,1-10H3/b20-11+,21-12+,22-18+/t23-,24+,27-,28+,29+,30+,31-,33-,38-,39-/m0/s1 |
| InChIKey | GYIJTMQVZGAZIB-DHJRGDPVSA-N |
| Mol Weight | 676.8 g/mol |
| Molecular Formula | C39H48O10 |
| Exact Mass | 676.324748 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 | HB7LPOrlptU |
|---|---|
| Name | 12-O-ACETYL-7-BENZOYLINGOL_3,8-DITIGLATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H48O10 |
| InChI | InChI=1S/C39H48O10/c1-11-20(3)34(42)47-31-28-27(37(28,9)10)30(45-25(8)40)24(7)32(41)38-19-23(6)33(48-35(43)21(4)12-2)39(38,49-38)18-22(5)29(31)46-36(44)26-16-14-13-15-17-26/h11-18,23-24,27-31,33H,19H2,1-10H3/b20-11+,21-12+,22-18+/t23-,24+,27-,28+,29+,30+,31-,33-,38-,39-/m0/s1 |
| InChIKey | GYIJTMQVZGAZIB-DHJRGDPVSA-N |
| Literature Reference Author | X.L.LI,Y.LI,S.F.WANG,Y.L.ZHAO,K.C.LIU,X.M.WANG,Y.P.YANG |
| Literature Reference Citation | J.NAT.PROD.,72,1001(2009) |
| Literature Reference DOI | 10.1021/np800816n |
| Molecular Weight | 676.804 g/mol |
| Sample ID | 32686 |
| Solvent | CDCl3 |