| SpectraBase Compound ID | 1TwuZBOGRjB |
|---|---|
| InChI | InChI=1S/C40H54O6/c1-24(2)13-15-29(27(7)8)22-39-23-30(17-14-25(3)4)38(9,10)40(37(39)44,20-19-26(5)6)36(46-12)33(35(39)43)34(42)28-16-18-32(45-11)31(41)21-28/h14,16,18-19,21,29-30,41H,1,7,13,15,17,20,22-23H2,2-6,8-12H3/t29-,30+,39+,40-/m1/s1 |
| InChIKey | XVKMGHPLFTUBTD-CURLQPJVSA-N |
| Mol Weight | 630.9 g/mol |
| Molecular Formula | C40H54O6 |
| Exact Mass | 630.392039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 25rHZQrKeDB |
|---|---|
| Name | 3,14-DI-O-METHYLXANTHOCHYMOL |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H54O6 |
| InChI | InChI=1S/C40H54O6/c1-24(2)13-15-29(27(7)8)22-39-23-30(17-14-25(3)4)38(9,10)40(37(39)44,20-19-26(5)6)36(46-12)33(35(39)43)34(42)28-16-18-32(45-11)31(41)21-28/h14,16,18-19,21,29-30,41H,1,7,13,15,17,20,22-23H2,2-6,8-12H3/t29-,30+,39+,40-/m1/s1 |
| InChIKey | XVKMGHPLFTUBTD-CURLQPJVSA-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 | 630.865 g/mol |
| Solvent | CD3OD |