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3-(2',3'-DIHYDROXY-3',7'-DIMETHYLOCT-6'-ENYL)-4-HYDROXY-5-(3'',3''-DIMETHYLALLYL)-BENZOIC-ACID;MYRICOIDIOL
SpectraBase Compound ID 5UGxjld2CF3
InChI InChI=1S/C22H32O5/c1-14(2)7-6-10-22(5,27)19(23)13-17-12-18(21(25)26)11-16(20(17)24)9-8-15(3)4/h7-8,11-12,19,23-24,27H,6,9-10,13H2,1-5H3,(H,25,26)
InChIKey UOIWBCLMKMGORV-UHFFFAOYSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3E5FKMHSGm
Name 3-(2',3'-DIHYDROXY-3',7'-DIMETHYLOCT-6'-ENYL)-4-HYDROXY-5-(3'',3''-DIMETHYLALLYL)-BENZOIC-ACID;MYRICOIDIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-14(2)7-6-10-22(5,27)19(23)13-17-12-18(21(25)26)11-16(20(17)24)9-8-15(3)4/h7-8,11-12,19,23-24,27H,6,9-10,13H2,1-5H3,(H,25,26)
InChIKey UOIWBCLMKMGORV-UHFFFAOYSA-N
Literature Reference Author S.B.BLUNT,T.B.CHEN,D.F.WIEMER
Literature Reference Citation J.NAT.PROD.,61,1400(1998)
Literature Reference DOI 10.1021/np980098j
Molecular Weight 376.493 g/mol
Solvent CDCl3
Source File Reference UWCS19616