General Information of the Compound
| Compound ID |
CP0903541
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| Compound Name |
5-(carboxymethoxy)-2-hydroxy-3-(5-((((R)-2-((R)-1-(hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzoic acid
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| Structure |
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| Formula |
C26H33N3O11
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| Molecular Weight |
563.56
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(OCC(=O)O)cc(C(=O)O)c2O)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C26H33N3O11/c1-3-5-6-7-16(19(4-2)29(38)14-30)24(34)27-13-28-25(35)21-9-8-20(40-21)17-10-15(39-12-22(31)32)11-18(23(17)33)26(36)37/h8-11,14,16,19,33,38H,3-7,12-13H2,1-2H3,(H,27,34)(H,28,35)(H,31,32)(H,36,37)/t16-,19-/m1/s1
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| InChIKey |
MVGYSELXXWZWIN-VQIMIIECSA-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: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2