General Information of the Compound
| Compound ID |
CP0909926
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| Compound Name |
3-Hydroxy-5-phenylpentanoic acid 3-D-glucopyranoside
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| Structure |
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| Formula |
C17H24O8
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| Molecular Weight |
356.371
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| Canonical SMILES |
O=C(O)CC(CCc1ccccc1)O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O
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| InChI |
InChI=1S/C17H24O8/c18-9-12-14(21)15(22)16(23)17(25-12)24-11(8-13(19)20)7-6-10-4-2-1-3-5-10/h1-5,11-12,14-18,21-23H,6-9H2,(H,19,20)/t11?,12-,14-,15+,16-,17-/m0/s1
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| InChIKey |
HRYIDVZLDQBLFF-HURARVKQSA-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: PT06670, Synaptojanin-1
Protein ID: PT06669, Synaptojanin-2