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2',3,4-Trihydroxy-6'-methoxy-2'',2''-dimethylpyrano[2'',3'':3',4']-chalcone, 3-hydroxyxanthohumol C
SpectraBase Compound ID IMoKYt24vC2
InChI InChI=1S/C21H20O6/c1-21(2)9-8-13-17(27-21)11-18(26-3)19(20(13)25)15(23)7-5-12-4-6-14(22)16(24)10-12/h4-11,22,24-25H,1-3H3/b7-5+
InChIKey AFSMQHYWBZUIHF-FNORWQNLSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bt42Cw3RHPt
Name 2',3,4-Trihydroxy-6'-methoxy-2'',2''-dimethylpyrano[2'',3'':3',4']-chalcone, 3-hydroxyxanthohumol C
Alternate Name(s) (E)-3-(3,4-dihydroxyphenyl)-1-(5-hydroxy-7-methoxy-2,2-dimethyl-1-benzopyran-6-yl)-2-propen-1-one (E)-3-(3,4-dihydroxyphenyl)-1-(5-hydroxy-7-methoxy-2,2-dimethylchromen-6-yl)prop-2-en-1-one (E)-3-[3,4-bis(oxidanyl)phenyl]-1-(7-methoxy-2,2-dimethyl-5-oxidanyl-chromen-6-yl)prop-2-en-1-one
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Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-21(2)9-8-13-17(27-21)11-18(26-3)19(20(13)25)15(23)7-5-12-4-6-14(22)16(24)10-12/h4-11,22,24-25H,1-3H3/b7-5+
InChIKey AFSMQHYWBZUIHF-FNORWQNLSA-N
Molecular Weight 368.385 g/mol
SMILES Oc1c(C(\C=C\c2ccc(c(c2)O)O)=O)c(cc2OC(C=Cc12)(C)C)OC
SPLASH splash10-014i-0095000000-fb8a5e21da666913f478
Source of Spectrum F2-45-2211-11
Wiley ID 1689207