Silicristin

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Properties Simple | Detailed

Formula C25H22O10
IUPAC Name (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-yl]chroman-4-one
Molecular Mass 482.436 g·mol−1
Heat of Formation -1465.7 ± 16.7 kJ·mol−1
Dipole Moment 2.64 ± 1.08 D
Volume 522.13 Å 3
Surface Area 448.69 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]chroman-4-one
  • (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-yl]chroman-4-one
  • (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-methylol-2,3-dihydrobenzofuran-5-yl]chroman-4-one
  • (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]chroman-4-one
  • (2s,3s)-3,5,7-trihydroxy-2-[(2r,3s)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydrobenzofuran-5-yl]-4-chromanone
InChIKey BMLIIPOXVWESJG-BEHJKJNDSA-N
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