General Information of the Compound
Compound ID
CP0794469
Compound Name
Eriodictyol-7-O-glucoside
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Structure
Formula
C21H22O11
Molecular Weight
450.396
Canonical SMILES
O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21
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InChI
InChI=1S/C21H22O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-5,14,16,18-25,27-29H,6-7H2/t14-,16+,18+,19-,20+,21+/m0/s1
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InChIKey
RAFHNDRXYHOLSH-SFTVRKLSSA-N
Physicochemical Property
logP
-0.3114
Rotatable Bonds
4
Heavy Atom Count
32
Polar Areas
186.37
Hydrogen Bond Donor Count
7
Hydrogen Bond Acceptor Count
11
Complexity
32

"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).

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PubChem ID
CID: 13254473
ChEMBL ID
CHEMBL509624
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06670, Synaptojanin-1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  1
1
IC50 <= 15900 nM
   TI
   LI
   LO
   TS
Protein ID: PT06669, Synaptojanin-2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  1
1
IC50 = 874 nM
   TI
   LI
   LO
   TS