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ISOLUPINISOFLAVONE-E
SpectraBase Compound ID D4kl3S3yxzt
InChI InChI=1S/C25H26O7/c1-24(2,28)19-8-13-7-12(5-6-16(13)31-19)15-11-30-18-10-17-14(22(26)21(18)23(15)27)9-20(32-17)25(3,4)29/h5-7,10-11,19-20,26,28-29H,8-9H2,1-4H3
InChIKey IKQKRLWGUMCUMA-UHFFFAOYSA-N
Mol Weight 438.48 g/mol
Molecular Formula C25H26O7
Exact Mass 438.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGLql5kTDJH
Name Isolupin-isoflavone
Alternate Name(s) 4-Hydroxy-2-(2-hydroxypropan-2-yl)-6-[2-(2-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-5-yl]-2,3-dihydrofuro[3,2-g][1]benzopyran-5-one 4-Hydroxy-2-(2-hydroxypropan-2-yl)-6-[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one 4-Hydroxy-2-(1-hydroxy-1-methyl-ethyl)-6-[2-(1-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one 4-Oxidanyl-2-(2-oxidanylpropan-2-yl)-6-[2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one
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Formula C25H26O7
InChI InChI=1S/C25H26O7/c1-24(2,28)19-8-13-7-12(5-6-16(13)31-19)15-11-30-18-10-17-14(22(26)21(18)23(15)27)9-20(32-17)25(3,4)29/h5-7,10-11,19-20,26,28-29H,8-9H2,1-4H3
InChIKey IKQKRLWGUMCUMA-UHFFFAOYSA-N
Molecular Weight 438.476 g/mol
SMILES OC(C1Cc2cc(C=3C(c4c(cc5OC(Cc5c4O)C(O)(C)C)OC3)=O)ccc2O1)(C)C
SPLASH splash10-000i-0002900000-c9993f3acda20c160a54
Source of Spectrum G4-60-293-2
Wiley ID 1606668