Drug Information

Drug General Information
Drug ID
D0E0JN
Former ID
DNC013916
Drug Name
CEPHARANTINE
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529537]
Structure
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2D MOL

3D MOL
Formula
C37H38N2O6
Canonical SMILES
CN1CCC2=CC3=C(C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7C8<br />=CC(=C(C=C8CCN7C)OC)O4)OC)OCO3
InChI
1S/C37H38N2O6/c1-38-13-11-24-18-31(41-4)33-20-27(24)28(38)16-23-7-10-30(40-3)32(17-23)44-26-8-5-22(6-9-26)15-29-35-25(12-14-39(29)2)19-34-36(37(35)45-33)43-21-42-34/h5-10,17-20,28-29H,11-16,21H2,1-4H3/t28-,29-/m0/s1
InChIKey
YVPXVXANRNDGTA-VMPREFPWSA-N
PubChem Compound ID
7098680
Target and Pathway
Target(s) Trypanothione reductase Target Info Inhibitor [529537]
References
Ref 529537Bioorg Med Chem. 2008 Jul 15;16(14):6689-95. Epub 2008 Jun 2.The use of natural product scaffolds as leads in the search for trypanothione reductase inhibitors.
Ref 529537Bioorg Med Chem. 2008 Jul 15;16(14):6689-95. Epub 2008 Jun 2.The use of natural product scaffolds as leads in the search for trypanothione reductase inhibitors.

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