| SpectraBase Compound ID | 62mfvVxe9KW |
|---|---|
| InChI | InChI=1S/C38H50O6/c1-22(2)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,27-28,39-40,42H,7,13,15,18,20-21H2,1-6,8-10H3/t27-,28+,37+,38-/m1/s1 |
| InChIKey | QDKLRKZQSOQWJQ-AKAMJVKKSA-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 | 3MPgNGjJUXG |
|---|---|
| Name | GUTTIFERONE-E |
| Compound Number | 1B |
| 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)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,27-28,39-40,42H,7,13,15,18,20-21H2,1-6,8-10H3/t27-,28+,37+,38-/m1/s1 |
| InChIKey | QDKLRKZQSOQWJQ-AKAMJVKKSA-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 | 602.811 g/mol |
| Solvent | CD3OD+0.1%TFA |
| Source File Reference | UWRU7354 |