Catalog |
BBC28608755 |
CAS |
28608-75-5 |
Structure |  |
Synonyms |
Orientin |
IUPAC Name |
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one |
Molecular Weight |
448.38 |
Molecular Formula |
C21H20O11 |
Canonical SMILES |
C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O |
InChI |
InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2/t14-,17-,18+,19-,21+/m1/s1 |
InChI Key |
PLAPMLGJVGLZOV-VPRICQMDSA-N |
Boiling Point |
816.1±65.0 °C |
Melting Point |
260-285 °C |
Purity |
98% |
Density |
1.759±0.06 g/ml |
Appearance |
Powder |
pKa |
6.24±0.40 |
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