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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB02840
http://purl.obolibrary.org/obo/dinto_DB02840
|
|---|---|
| Preferred Name | 4-(1,3-benzodioxol-5-yl)-5-(5-ethyl-2,4-dihydroxyphenyl)-2h-pyrazole-3-carboxylic acid |
| Synonyms |
C19H16N2O6
4-(2H-1,3-benzodioxol-5-yl)-3-(5-ethyl-2,4-dihydroxyphenyl)-1H-pyrazole-5-carboxylic acid
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | 4-(1,3-benzodioxol-5-yl)-5-(5-ethyl-2,4-dihydroxyphenyl)-2h-pyrazole-3-carboxylic acid
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|---|---|
| label | 4-(1,3-benzodioxol-5-yl)-5-(5-ethyl-2,4-dihydroxyphenyl)-2h-pyrazole-3-carboxylic acid
|
| type | |
| InChIKey | InChIKey=LCTWZJKHOGKNMX-UHFFFAOYSA-N
|
| Synonym |
C19H16N2O6
4-(2H-1,3-benzodioxol-5-yl)-3-(5-ethyl-2,4-dihydroxyphenyl)-1H-pyrazole-5-carboxylic acid
|
| xref |
PDB:4BC
ChemSpider:13007150
BindingDB:50161650
PubChem Substance:46509084
PubChem Compound:5326934
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| prefixIRI | obo2:dinto_DB02840
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| related with | |
| SMILES | CCC1=C(O)C=C(O)C(=C1)C1=NNC(C(O)=O)=C1C1=CC=C2OCOC2=C1
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| InChI | InChI=1S/C19H16N2O6/c1-2-9-5-11(13(23)7-12(9)22)17-16(18(19(24)25)21-20-17)10-3-4-14-15(6-10)27-8-26-14/h3-7,22-23H,2,8H2,1H3,(H,20,21)(H,24,25)
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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| No notes to display |