General Information of the Compound
| Compound ID |
CP0511459
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| Compound Name |
(2R,3S,4R,5R,6S)-2-Hydroxymethyl-6-(3'-methyl-biphenyl-3-yl)-tetrahydro-pyran-3,4,5-triol
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| Structure |
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| Formula |
C19H22O5
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| Molecular Weight |
330.38
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| Canonical SMILES |
Cc1cccc(c1)-c1cccc(c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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| InChI |
InChI=1S/C19H22O5/c1-11-4-2-5-12(8-11)13-6-3-7-14(9-13)19-18(23)17(22)16(21)15(10-20)24-19/h2-9,15-23H,10H2,1H3/t15-,16-,17+,18-,19+/m1/s1
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| InChIKey |
NCGITCMKOZTTKR-FQBWVUSXSA-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