Therapeutic Targets Database
BIDD Pharmainformatics Databases
 
   
   

 

TTD Drug ID: DNC001476

Drug Information
NameTubacin
CompanyBroad Institute
IndicationMultiple myeloma
[ICD9: 203.0   ICD10: C90.0]
Experimental    
Structure

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InChI1S/C41H43N3O7S/c45-26-28-17-19-29(20-18-28)35-25-34(27-52-41-43-3
8(30-11-5-3-6-12-30)39(51-41)31-13-7-4-8-14-31)49-40(50-35)32-21-
23-33(24-22-32)42-36(46)15-9-1-2-10-16-37(47)44-48/h3-8,11-14,17-
24,34-35,40,45,48H,1-2,9-10,15-16,25-27H2,(H,42,46)(H,44,47)/t34-
,35+,40+/m1/s1
InChIKeyBHUZLJOUHMBZQY-YXQOSMAKSA-N
Canonical SMILESC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)NO)CSC4=NC(=C
(O4)C5=CC=CC=C5)C6=CC=CC=C6    
Isomeric SMILESC1[C@@H](O[C@@H](O[C@@H]1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)
NO)CSC4=NC(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6
PubChem Compound IDCID 6675804.
PubChem Substance IDSID 11301280.
TargetHistone deacetylase 6Inhibitor[1][2]
Ref 1Emerging therapies for multiple myeloma. Expert Opin Emerg Drugs. 2009 Mar;14(1):99-127. To Reference
Ref 2Nat Rev Drug Discov. 2006 Sep;5(9):769-84.Anticancer activities of histone deacetylase inhibitors. To Reference



 

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