General Information of the Compound
| Compound ID |
CP0391277
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| Compound Name |
(1R,2R)-2-[(4-hydroxybenzene)amido]cyclopentyl 4-{[2-(ethoxycarbonyl)-6-hydroxyphenyl]carbonyl}-3,5-dihydroxybenzoate
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| Structure |
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| Formula |
C29H27NO10
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| Molecular Weight |
549.532
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| Canonical SMILES |
CCOC(=O)c1cccc(O)c1C(=O)c1c(O)cc(cc1O)C(=O)O[C@@H]1CCC[C@H]1NC(=O)c1ccc(O)cc1
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| InChI |
InChI=1S/C29H27NO10/c1-2-39-29(38)18-5-3-7-20(32)24(18)26(35)25-21(33)13-16(14-22(25)34)28(37)40-23-8-4-6-19(23)30-27(36)15-9-11-17(31)12-10-15/h3,5,7,9-14,19,23,31-34H,2,4,6,8H2,1H3,(H,30,36)/t19-,23-/m1/s1
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| InChIKey |
MGLBGUZLARZAOR-AUSIDOKSSA-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: PT00858, Protein kinase C alpha type
Protein ID: PT01495, Protein kinase C beta type
Protein ID: PT01364, Protein kinase C delta type
Protein ID: PT01271, Protein kinase C epsilon type
Protein ID: PT00938, Protein kinase C eta type