General Information of the Compound
| Compound ID |
CP0527206
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| Compound Name |
6,6,9-trimethyl-3-pentylbenzo[c]chromene-1,4-dione
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| Structure |
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| Formula |
C21H24O3
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| Molecular Weight |
324.42
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| Canonical SMILES |
CCCCCC1=CC(=O)C2=C(OC(C)(C)c3ccc(C)cc23)C1=O
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| InChI |
InChI=1S/C21H24O3/c1-5-6-7-8-14-12-17(22)18-15-11-13(2)9-10-16(15)21(3,4)24-20(18)19(14)23/h9-12H,5-8H2,1-4H3
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| InChIKey |
UFDYTRQMIXJHTH-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