General Information of the Compound
| Compound ID |
CP0176887
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| Compound Name |
(2E,4E)-5-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)penta-2,4-dien-1-one
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| Formula |
C18H16O4
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| Molecular Weight |
296.322
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| Canonical SMILES |
COc1cc(\C=C\C=C\C(=O)c2ccc(O)cc2)ccc1O
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| InChI |
InChI=1S/C18H16O4/c1-22-18-12-13(6-11-17(18)21)4-2-3-5-16(20)14-7-9-15(19)10-8-14/h2-12,19,21H,1H3/b4-2+,5-3+
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| InChIKey |
QAVLJFHJNQFAJN-ZUVMSYQZSA-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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