General Information of the Compound
| Compound ID |
CP0874271
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| Compound Name |
2,2'-(4,4'-(3,6,9,12-tetraoxatetradecane-1,14-diylbis(oxy))bis(4,1-phenylene))bis(7-methyl-4H-chromen-4-one)
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| Structure |
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| Formula |
C42H42O10
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| Molecular Weight |
706.788
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| Canonical SMILES |
Cc1ccc2c(=O)cc(-c3ccc(OCCOCCOCCOCCOCCOc4ccc(-c5cc(=O)c6ccc(C)cc6o5)cc4)cc3)oc2c1
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| InChI |
InChI=1S/C42H42O10/c1-29-3-13-35-37(43)27-39(51-41(35)25-29)31-5-9-33(10-6-31)49-23-21-47-19-17-45-15-16-46-18-20-48-22-24-50-34-11-7-32(8-12-34)40-28-38(44)36-14-4-30(2)26-42(36)52-40/h3-14,25-28H,15-24H2,1-2H3
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| InChIKey |
WTNNRNLONUGGQI-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