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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one , 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-1-benzopyran-4-one , 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one , 2-(4-hydroxyphenyl)-7-[(2S,4S,5R)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,5-bis(oxidanyl)chromen-4-one , 3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromone
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| Smiles: |
O[C@H]1[C@@H](O[C@H]([C@@H]([C@@H]1O)O)C)Oc1cc(O)c2c(c1)oc(c(c2=O)O)c1ccc(cc1)O
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| InChi : |
InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17-,19+,21-/m0/s1
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| InChi Key : |
InChIKey=HQNOUCSPWAGQND-MQNNAEJASA-N
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| PubChem ID : |
44258922
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| Rotatable bond count : |
3
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Rule of five : |
1
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| Hydrogen bond acceptor count : |
10
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Ionization potential : |
8.891738
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| Hydrogen bond donor count : |
6
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Electric dipole moment : |
3.741
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| XLogP : |
0.883
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VDW volume : |
367.356898
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| Molecular weight : |
432.105647
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HOMO-LUMO gap : |
7.789000
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| Herb list : |
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| Refrences & Litretures: |
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