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3,13,14-TRI-O-METHYLGUTTIFERONE-E

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3,13,14-TRI-O-METHYLGUTTIFERONE-E
SpectraBase Compound ID GZDsrF1osQG
InChI InChI=1S/C41H56O6/c1-25(2)14-16-30(28(7)8)23-40-24-31(18-15-26(3)4)39(9,10)41(38(40)44,21-20-27(5)6)37(47-13)34(36(40)43)35(42)29-17-19-32(45-11)33(22-29)46-12/h14-15,17,19-20,22,30-31H,7,16,18,21,23-24H2,1-6,8-13H3/t30-,31+,40+,41-/m1/s1
InChIKey PWGFBBWFSSOGSY-PMXNMUGASA-N
Mol Weight 644.9 g/mol
Molecular Formula C41H56O6
Exact Mass 644.40769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LebMKv6wQAw
Name 3,13,14-TRI-O-METHYLGUTTIFERONE-E
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H56O6
InChI InChI=1S/C41H56O6/c1-25(2)14-16-30(28(7)8)23-40-24-31(18-15-26(3)4)39(9,10)41(38(40)44,21-20-27(5)6)37(47-13)34(36(40)43)35(42)29-17-19-32(45-11)33(22-29)46-12/h14-15,17,19-20,22,30-31H,7,16,18,21,23-24H2,1-6,8-13H3/t30-,31+,40+,41-/m1/s1
InChIKey PWGFBBWFSSOGSY-PMXNMUGASA-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 644.892 g/mol
Solvent CD3OD