Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D00TWK
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| Former ID |
DNC003145
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| Drug Name |
5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol
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| Synonyms |
Dihydroresveratrol; 58436-28-5; 5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol; 3,4',5-Trihydroxybibenzyl; CHEMBL111234; CHEBI:4582; 5-(4-hydroxyphenethyl)benzene-1,3-diol; Dihydroresveratol; 3ftu; Dihydro-Resveratrol; RE2; a, b-Dihydroresveratrol; AC1L4HRG; C10255; 5-[2-(4-hydroxyphenyl)ethyl]-1,3-Benzenediol; 3,5,4'-trihydroxybibenzyl; 3,4'',5-trihydroxybibenzyl; 1,3-Benzenediol, 5-(2-(4-hydroxyphenyl)ethyl)-; SCHEMBL716856; AC1Q79W7; CTK5A8302; MolPort-035-706-156; ZINC899123; LMPK13090035; BDBM50085531; NSC723534; AKOS030555676
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C14H14O3
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| Canonical SMILES |
C1=CC(=CC=C1CCC2=CC(=CC(=C2)O)O)O
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| InChI |
1S/C14H14O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h3-9,15-17H,1-2H2
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| InChIKey |
HITJFUSPLYBJPE-UHFFFAOYSA-N
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| CAS Number |
CAS 58436-28-5
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| PubChem Compound ID | ||||
| PubChem Substance ID |
12441, 537053, 585341, 835825, 7540740, 10260434, 14868148, 33507981, 57396007, 74382068, 79732011, 84981849, 84981863, 99444937, 103143577, 103333150, 103984978, 113437117, 117616346, 135164902, 137041286, 138513796, 141348849, 160644028, 160657209, 160969503, 162876619, 170482128, 172131874, 177013190, 179316586, 223439545, 224570910, 227006185, 242059054, 243751948, 252551284
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| ChEBI ID |
CHEBI:4582
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Leukotriene A-4 hydrolase (LTA4H) | Target Info | Inhibitor | [1] |
| BioCyc | Leukotriene biosynthesis | |||
| KEGG Pathway | Arachidonic acid metabolism | |||
| Metabolic pathways | ||||
| Pathwhiz Pathway | Arachidonic Acid Metabolism | |||
| WikiPathways | Arachidonic acid metabolism | |||
| Eicosanoid Synthesis | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
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