| SpectraBase Compound ID | FKihdNWgVUn |
|---|---|
| InChI | InChI=1S/C34H42O9/c1-9-17(2)30(38)41-27-24-23(32(24,7)8)26(40-21(6)35)20(5)28(37)33-16-19(4)29(34(33,43-33)15-18(3)25(27)36)42-31(39)22-13-11-10-12-14-22/h9-15,19-20,23-27,29,36H,16H2,1-8H3/b17-9+,18-15+/t19-,20+,23-,24+,25+,26+,27-,29-,33-,34-/m0/s1 |
| InChIKey | FYGIUALPJJOYCO-DQOMFPQGSA-N |
| Mol Weight | 594.7 g/mol |
| Molecular Formula | C34H42O9 |
| Exact Mass | 594.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Kc0Zj7LKWp |
|---|---|
| Name | 12-O-ACETYL-3-O-BENZOYLINGOL-8-TIGLATE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O9 |
| InChI | InChI=1S/C34H42O9/c1-9-17(2)30(38)41-27-24-23(32(24,7)8)26(40-21(6)35)20(5)28(37)33-16-19(4)29(34(33,43-33)15-18(3)25(27)36)42-31(39)22-13-11-10-12-14-22/h9-15,19-20,23-27,29,36H,16H2,1-8H3/b17-9+,18-15+/t19-,20+,23-,24+,25+,26+,27-,29-,33-,34-/m0/s1 |
| InChIKey | FYGIUALPJJOYCO-DQOMFPQGSA-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 | 594.702 g/mol |
| Sample ID | 32691 |
| Solvent | CDCl3 |