General Information of the Compound
| Compound ID |
CP0533580
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| Compound Name |
7,8-dihydroxy-3-(4-hydroxyphenyl)chromen-2-one
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| Structure |
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| Formula |
C15H10O5
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| Molecular Weight |
270.24
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| Canonical SMILES |
Oc1ccc(cc1)-c1cc2ccc(O)c(O)c2oc1=O
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| InChI |
InChI=1S/C15H10O5/c16-10-4-1-8(2-5-10)11-7-9-3-6-12(17)13(18)14(9)20-15(11)19/h1-7,16-18H
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| InChIKey |
SHWFFEHIZXPZOK-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a
Protein ID: PT01278, Adenosine receptor A2b
Protein ID: PT01279, Adenosine receptor A3