Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0DQ2G
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| Former ID |
DNC003277
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| Drug Name |
2-tert-butylbenzene-1,4-diol
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| Synonyms |
Tert-Butylhydroquinone; tert-Butylhydroquinone; 1948-33-0; TBHQ; 2-tert-Butylhydroquinone; T-BUTYLHYDROQUINONE; MTBHQ; t-Butyl hydroquinone; 2-tert-Butyl-1,4-benzenediol; 2-t-Butylhydroquinone; Mono-tert-butylhydroquinone; Sustane; Tenox TBHQ; tert-Butyl-1,4-benzenediol; Mono-tertiarybutylhydroquinone; Hydroquinone, tert-butyl-; Banox 20BA; 1,4-Benzenediol, 2-(1,1-dimethylethyl)-; tertiary-Butylhydroquinone; 2-(1,1-Dimethylethyl)-1,4-benzenediol; 2-tert-Butyl(1,4)hydroquinone; 2-(tert-butyl)benzene-1,4-diol
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2], [3], [4], [5] | |
| Structure |
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Download2D MOL |
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| Formula |
C10H14O2
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| Canonical SMILES |
CC(C)(C)C1=C(C=CC(=C1)O)O
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| InChI |
1S/C10H14O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,11-12H,1-3H3
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| InChIKey |
BGNXCDMCOKJUMV-UHFFFAOYSA-N
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| CAS Number |
CAS 1948-33-0
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| PubChem Compound ID | ||||
| PubChem Substance ID |
71164, 3135298, 4252498, 4434961, 7979960, 8138473, 8162031, 10320549, 10512281, 11408587, 11457665, 11459425, 11528306, 12050651, 15194956, 17388706, 17390000, 24847122, 26651687, 26752804, 29283936, 31510404, 48413351, 48415677, 48419623, 48422749, 48425655, 48425661, 50105455, 50860825, 53787140, 56311045, 56311788, 56311790, 56312714, 56313786, 56313787, 56437575, 56437576, 57329228, 58008877, 87563817, 88802761, 90342005, 92710016, 96022603, 99355621, 99444197, 103529487, 104171088
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| ChEBI ID |
CHEBI:78886
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| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Influenza Hemagglutinin (Influ HA) | Target Info | Inhibitor | [1], [2], [3], [4], [5] |
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Structure of influenza hemagglutinin in complex with an inhibitor of membrane fusion. Proc Natl Acad Sci U S A. 2008 Nov 18;105(46):17736-41. | |||
| REF 2 | Novel stachyflin derivatives from Stachybotrys sp. RF-7260. Fermentation, isolation, structure elucidation and biological activities. J Antibiot (Tokyo). 2002 Mar;55(3):239-48. | |||
| REF 3 | An approach to the identification of potent inhibitors of influenza virus fusion using parallel synthesis methodology. Bioorg Med Chem Lett. 2001 Sep 3;11(17):2393-6. | |||
| REF 4 | Inhibition of influenza A virus replication by compounds interfering with the fusogenic function of the viral hemagglutinin. J Virol. 1999 Jan;73(1):140-51. | |||
| REF 5 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
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