196

3-(3-FLUORO-4-HYDROXYPHENYL)-7-HYDROXY-1-NAPHTHONITRILE

Find entries where: 196

is present as a standalone ligand in 1 entries

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Chemical Component Summary
Name	3-(3-FLUORO-4-HYDROXYPHENYL)-7-HYDROXY-1-NAPHTHONITRILE
Identifiers	3-(3-fluoro-4-hydroxy-phenyl)-7-hydroxy-naphthalene-1-carbonitrile
Formula	C₁₇ H₁₀ F N O₂
Molecular Weight	279.265
Type	NON-POLYMER
Isomeric SMILES	c1cc(cc2c1cc(cc2C#N)c3ccc(c(c3)F)O)O
InChI	InChI=1S/C17H10FNO2/c18-16-7-10(2-4-17(16)21)12-5-11-1-3-14(20)8-15(11)13(6-12)9-19/h1-8,20-21H
InChIKey	NSSOSHDCWCMNDM-UHFFFAOYSA-N

Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	33
Aromatic Bond Count	18

Drug Info: DrugBank

DrugBank ID	DB06875
Name	ERB-196
Groups	experimental
Synonyms	ERB-196
Categories	Estrogen Receptor beta, agonists Naphthalenes
CAS number	550997-55-2

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Estrogen receptor beta	MDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYS...	unknown
Nuclear receptor coactivator 1	MSGLGDSSSDPANPDSHKRKGSPCDTLASSTEKRRREQENKYLEELAELL...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682