CAS | 33889-69-9 |
Structure | |
Synonyms | (2R,3R)-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 |
IUPAC Name | (2R,3R)-3,5,7-trihydroxy-2-[(2R,3S)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrochromen-4-one |
Molecular Weight | 482.44 |
Molecular Formula | C25H22O10 |
Canonical SMILES | COC1=C(C=CC(=C1)[C@H]2[C@@H](C3=C(O2)C(=CC(=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)O)CO)O |
InChI | InChI=1S/C25H22O10/c1-33-18-6-10(2-3-15(18)28)23-14(9-26)13-4-11(5-17(30)25(13)35-23)24-22(32)21(31)20-16(29)7-12(27)8-19(20)34-24/h2-8,14,22-24,26-30,32H,9H2,1H3/t14-,22+,23+,24-/m1/s1 |
InChI Key | BMLIIPOXVWESJG-LMBCONBSSA-N |
Boiling Point | 782.0±60.0 °C |
Melting Point | 174-176 °C |
Purity | 98% |
Density | 1.578±0.06 g/ml |
pKa | 7.39±0.60 |
Appearance | Powder |
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