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ACROPYRONE;1-[6-[1-[3-ACETYL-2,6-DIHYDROXY-4-METHOXY-5-(3-METHYLBUT-2-EN-1-YL)-PHENYL]-3-METHYLBUTYL]-5,7-DIHYDROXY
SpectraBase Compound ID 8f0ZwC33tlA
InChI InChI=1S/C32H40O8/c1-15(2)10-11-19-26(35)24(28(37)22(17(5)33)30(19)39-9)21(14-16(3)4)25-27(36)20-12-13-32(7,8)40-31(20)23(18(6)34)29(25)38/h10,12-13,16,21,35-38H,11,14H2,1-9H3
InChIKey FABHBJUSRZUNRG-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C32H40O8
Exact Mass 552.272318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B5VF0kBi1ff
Name ACROPYRONE;1-[6-[1-[3-ACETYL-2,6-DIHYDROXY-4-METHOXY-5-(3-METHYLBUT-2-EN-1-YL)-PHENYL]-3-METHYLBUTYL]-5,7-DIHYDROXY
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H40O8
InChI InChI=1S/C32H40O8/c1-15(2)10-11-19-26(35)24(28(37)22(17(5)33)30(19)39-9)21(14-16(3)4)25-27(36)20-12-13-32(7,8)40-31(20)23(18(6)34)29(25)38/h10,12-13,16,21,35-38H,11,14H2,1-9H3
InChIKey FABHBJUSRZUNRG-UHFFFAOYSA-N
Literature Reference Author E.KOULOURA,M.HALABALAKI,M.C.LALLEMAND,S.NAM,R.JOVE,M.LITAUDO N,K.AWANG,H.A.HADI,A
Literature Reference Citation J.NAT.PROD.,75,1270(2012)
Literature Reference DOI 10.1021/np201007a
Molecular Weight 552.665 g/mol
Sample ID 41236
Solvent CDCl3