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(-)-(2S)-5,7,2'-Trihydroxy-8,3'-diprenylflavanone
SpectraBase Compound ID F5Sc82qwmH6
InChI InChI=1S/C25H28O5/c1-14(2)8-10-16-6-5-7-18(24(16)29)22-13-21(28)23-20(27)12-19(26)17(25(23)30-22)11-9-15(3)4/h5-9,12,22,26-27,29H,10-11,13H2,1-4H3/t22-/m0/s1
InChIKey SWLGFCRAFOKHQK-QFIPXVFZSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlwnMwSPrJJ
Name (-)-(2S)-5,7,2'-Trihydroxy-8,3'-diprenylflavanone
Appearance Amorphous solid
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Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-14(2)8-10-16-6-5-7-18(24(16)29)22-13-21(28)23-20(27)12-19(26)17(25(23)30-22)11-9-15(3)4/h5-9,12,22,26-27,29H,10-11,13H2,1-4H3/t22-/m0/s1
InChIKey SWLGFCRAFOKHQK-QFIPXVFZSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np1004664
Molecular Weight 408.494 g/mol
Optical Rotation [a]D25 = -75 (c = 0.41, MeOH)
Reported Formula C25H28O5
SMILES Oc1cc(c(c2O[C@](c3c(c(ccc3)CC=C(C)C)O)(CC(c12)=O)[H])CC=C(C)C)O
SPLASH splash10-014i-0900000000-8da44ce93abbfa2ad3e7
Source of Spectrum G4-74-161-2
Wiley ID 1849031