Drug Information

Drug General Information
Drug ID
D0AO6P
Former ID
DNC001466
Drug Name
Tricyclics
Drug Type
Small molecular drug
Indication Kinetoplastids [ICD9: 085, 086; ICD10:B55, B56, B57] Investigative [536135]
Structure
Download
2D MOL

3D MOL
Formula
C20H30O
Canonical SMILES
CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)C
InChI
1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+
InChIKey
FPIPGXGPPPQFEQ-OVSJKPMPSA-N
CAS Number
CAS 50-48-6
PubChem Compound ID
445354
PubChem Substance ID
3756, 416404, 603541, 821173, 824333, 826984, 838308, 842011, 3138738, 7890334, 8144182, 8149779, 10299682, 10532643, 11528329, 11537746, 12146301, 14714468, 14799924, 17389530, 24697570, 24890099, 24890100, 24899395, 26612235, 26680020, 26709666, 26710635, 26747393, 26747394, 26753109, 26753110, 36888084, 46393062, 46508191, 47193665, 47193688, 47208199, 47217041, 47217042, 47291361, 47440523, 48416515, 48422815, 48425698, 48484015, 50105638, 53788786, 56374000, 57404676
ChEBI ID
ChEBI:2666
Target and Pathway
Target(s) Trypanothione reductase Target Info Binder [536135]
References
Ref 536135Opportunities and challenges in antiparasitic drug discovery. Nat Rev Drug Discov. 2005 Sep;4(9):727-40.
Ref 536135Opportunities and challenges in antiparasitic drug discovery. Nat Rev Drug Discov. 2005 Sep;4(9):727-40.

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