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AMYRISIN_C;5,7-DIHYDROXY-6-METHOXY-2-(3-METHOXY-4-((3-METHYLBUT-2-EN-1-YL)-OXY)-PHENYL)-4-H-CHROMEN-4-ONE
SpectraBase Compound ID 4DT8Bqj3uj9
InChI InChI=1S/C22H22O7/c1-12(2)7-8-28-16-6-5-13(9-18(16)26-3)17-10-14(23)20-19(29-17)11-15(24)22(27-4)21(20)25/h5-7,9-11,24-25H,8H2,1-4H3
InChIKey ABZZDWBIZJSCNU-UHFFFAOYSA-N
Mol Weight 398.41 g/mol
Molecular Formula C22H22O7
Exact Mass 398.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Dmw3WIS9ZK
Name AMYRISIN_C;5,7-DIHYDROXY-6-METHOXY-2-(3-METHOXY-4-((3-METHYLBUT-2-EN-1-YL)-OXY)-PHENYL)-4-H-CHROMEN-4-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O7
InChI InChI=1S/C22H22O7/c1-12(2)7-8-28-16-6-5-13(9-18(16)26-3)17-10-14(23)20-19(29-17)11-15(24)22(27-4)21(20)25/h5-7,9-11,24-25H,8H2,1-4H3
InChIKey ABZZDWBIZJSCNU-UHFFFAOYSA-N
Literature Reference Author J.PENG,R.M.HARTLEY,G.A.FEST,S.L.MOOBERRY
Literature Reference Citation J.NAT.PROD.,75,494(2012)
Literature Reference DOI 10.1021/np200796e
Molecular Weight 398.412 g/mol
Sample ID 40206
Solvent CDCl3