| SpectraBase Compound ID | 7qNlGHxkL7q |
|---|---|
| InChI | InChI=1S/C38H50O6/c1-22(2)11-14-26-20-37-21-27(15-12-23(3)4)36(9,10)44-33(37)30(31(41)25-13-16-28(39)29(40)19-25)32(42)38(34(37)43,35(26,7)8)18-17-24(5)6/h11-13,16-17,19,26-27,39-40H,14-15,18,20-21H2,1-10H3/t26-,27-,37-,38-/m0/s1 |
| InChIKey | KXTNVBQRLRYVCO-PFACJMQPSA-N |
| Mol Weight | 602.8 g/mol |
| Molecular Formula | C38H50O6 |
| Exact Mass | 602.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GlnDNpfTulT |
|---|---|
| Name | 7-EPI-ISOGARCINOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H50O6 |
| InChI | InChI=1S/C38H50O6/c1-22(2)11-14-26-20-37-21-27(15-12-23(3)4)36(9,10)44-33(37)30(31(41)25-13-16-28(39)29(40)19-25)32(42)38(34(37)43,35(26,7)8)18-17-24(5)6/h11-13,16-17,19,26-27,39-40H,14-15,18,20-21H2,1-10H3/t26-,27-,37-,38-/m0/s1 |
| InChIKey | KXTNVBQRLRYVCO-PFACJMQPSA-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 | 602.811 g/mol |
| Sample ID | 63909 |
| Solvent | C5D5N |