General Information of the Compound
| Compound ID |
CP0000043
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| Compound Name |
(R)-1,2,3,6,8-pentahydroxy-7-(1-methoxyethyl)anthracene-9,10-dione
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| Structure |
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| Formula |
C17H14O8
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| Molecular Weight |
346.291
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| Canonical SMILES |
CO[C@H](C)c1c(O)cc2C(=O)c3cc(O)c(O)c(O)c3C(=O)c2c1O
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| InChI |
InChI=1S/C17H14O8/c1-5(25-2)10-8(18)3-6-11(15(10)22)16(23)12-7(13(6)20)4-9(19)14(21)17(12)24/h3-5,18-19,21-22,24H,1-2H3/t5-/m1/s1
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| InChIKey |
VNAWZSWHDQAJAB-RXMQYKEDSA-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: PT00922, Epidermal growth factor receptor
Protein ID: PT06041, Protein kinase C epsilon type