| SpectraBase Compound ID | LHF5ouENhoE |
|---|---|
| InChI | InChI=1S/C38H50O5/c1-23(2)14-16-28(26(7)8)21-37-22-29(17-15-24(3)4)36(9,10)38(35(37)43,19-18-25(5)6)34(42)31(33(37)41)32(40)27-12-11-13-30(39)20-27/h11-15,18,20,28-29,39,41H,7,16-17,19,21-22H2,1-6,8-10H3/t28?,29-,37-,38+/m1/s1 |
| InChIKey | XORARNCRDSLZCS-KFHSXBBQSA-N |
| Mol Weight | 586.8 g/mol |
| Molecular Formula | C38H50O5 |
| Exact Mass | 586.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GBAFOjwtuig |
|---|---|
| Name | 14-DEOXY-GARCINOL |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H50O5 |
| InChI | InChI=1S/C38H50O5/c1-23(2)14-16-28(26(7)8)21-37-22-29(17-15-24(3)4)36(9,10)38(35(37)43,19-18-25(5)6)34(42)31(33(37)41)32(40)27-12-11-13-30(39)20-27/h11-15,18,20,28-29,39,41H,7,16-17,19,21-22H2,1-6,8-10H3/t28?,29-,37-,38+/m1/s1 |
| InChIKey | XORARNCRDSLZCS-KFHSXBBQSA-N |
| Literature Reference Author | G.MARTI,V.EPARVIER,C.MORETTI,S.SUSPLUGAS,S.PRADO,P.GRELLIER, P.RETAILLEAU,F.GUERI |
| Literature Reference Citation | PHYTOCHEM.,70,75(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.10.005 |
| Molecular Weight | 586.812 g/mol |
| Sample ID | 63916 |
| Solvent | C5D5N |