| SpectraBase Compound ID | 8FLt9SNJ34K |
|---|---|
| InChI | InChI=1S/C39H52O6/c1-23(2)12-14-28(26(7)8)21-38-22-29(16-13-24(3)4)37(9,10)39(36(38)44,19-18-25(5)6)35(43)32(34(38)42)33(41)27-15-17-30(40)31(20-27)45-11/h12-13,15,17-18,20,28-29,40,42H,7,14,16,19,21-22H2,1-6,8-11H3/t28-,29+,38+,39-/m1/s1 |
| InChIKey | IRGODUUTQDWGCW-QNGDIKFMSA-N |
| Mol Weight | 616.8 g/mol |
| Molecular Formula | C39H52O6 |
| Exact Mass | 616.376389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GHrLF9xopj |
|---|---|
| Name | 13-O-METHYLGUTTIFERONE-E |
| Compound Number | 12B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H52O6 |
| InChI | InChI=1S/C39H52O6/c1-23(2)12-14-28(26(7)8)21-38-22-29(16-13-24(3)4)37(9,10)39(36(38)44,19-18-25(5)6)35(43)32(34(38)42)33(41)27-15-17-30(40)31(20-27)45-11/h12-13,15,17-18,20,28-29,40,42H,7,14,16,19,21-22H2,1-6,8-11H3/t28-,29+,38+,39-/m1/s1 |
| InChIKey | IRGODUUTQDWGCW-QNGDIKFMSA-N |
| Literature Reference Author | D.ROUX,H.A.HADI,S.THORET,D.GUENARD,O.THOISON,M.PAIS,T.SEVENE T |
| Literature Reference Citation | J.NAT.PROD.,63,1070(2000) |
| Literature Reference DOI | 10.1021/np0000872 |
| Molecular Weight | 616.838 g/mol |
| Solvent | CD3OD+0.1%TFA |