General Information of the Compound
| Compound ID |
CP0050531
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| Compound Name |
1-(2,4-dihydroxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-(4-hydroxyphenyl)propan-1-one
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| Synonyms |
1-Propanone, 1-(2-(b
1-[2-(beta-D-Glucopyranosyloxy)-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)-1-propanone
2'-(beta-D-Glucopyranosyloxy)-4',6'-dihydroxy-3-(4-hydroxyphenyl)propiophenone
60-81-1
AI3-19835
CHEBI:8113
CHEMBL245067
CU9S17279X
EINECS 200-487-1
Floridzin
IOUVKUPGCMBWBT-QNDFHXLGSA-N
NSC 2833
Phloretin 2'-glucoside
Phloretin-2'-O-beta-glucoside
Phloretin-2'-beta-glucoside
Phlorhizin
Phloridzin
Phloridzin dihydrate
Phloridzosid
Phlorizin
Phlorizine
Phlorizoside
Phlorrhizen
Phlorrhizin
UNII-CU9S17279X
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| Structure |
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| Formula |
C21H24O10
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| Molecular Weight |
436.413
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| Canonical SMILES |
OC[C@H]1O[C@@H](Oc2cc(O)cc(O)c2C(=O)CCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
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| InChI |
InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1
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| InChIKey |
IOUVKUPGCMBWBT-QNDFHXLGSA-N
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| CAS |
112318-65-7
60-81-1
52276-56-9
16055-86-0
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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: PT06111, Probable glucose sensor protein SLC5A4
Protein ID: PT03804, Sodium/glucose cotransporter 1
Cell-based Assay
Protein ID: PT03888, Sodium/glucose cotransporter 1
Protein ID: PT02415, Sodium/glucose cotransporter 2
Cell-based Assay
Protein ID: PT02832, Sodium/glucose cotransporter 2
Protein ID: PT06782, Solute carrier family 28 member 3
Clinical Information about the Compound