Drug Information

Drug General Information
Drug ID
D0G5FV
Former ID
DNC001438
Drug Name
Thiostrepton
Drug Type
Small molecular drug
Indication Discovery agent Investigative [535329]
Structure
Download
2D MOL

3D MOL
Formula
C72H85N19O18S5
Canonical SMILES
CCC(C)C1C(=O)NC(C(=O)NC(=C)C(=O)NC(C(=O)NC23CCC(=NC2C4=<br />CSC(=N4)C(C(OC(=O)C5=NC6=C(C=CC(C6O)N1)C(=C5)C(C)O)C)NC<br />(=O)C7=CSC(=N7)C(NC(=O)C8CSC(=N8)C(=CC)NC(=O)C(NC(=O)C9<br />=CSC3=N9)C(C)O)C(C)(C(C)O)O)C1=NC(=CS1)C(=O)NC(=C)C(=O)<br />NC(=C)C(=O)N)C)C
InChI
1S/C72H85N19O18S5/c1-14-26(3)47-63(105)78-30(7)57(99)75-28(5)56(98)76-31(8)58(100)91-72-19-18-40(66-85-43(22-111-66)59(101)77-29(6)55(97)74-27(4)54(73)96)81-52(72)42-21-112-67(83-42)49(34(11)109-69(107)41-20-37(32(9)92)36-16-17-39(79-47)51(95)50(36)80-41)89-60(102)44-24-113-68(86-44)53(71(13,108)35(12)94)90-62(104)45-23-110-65(84-45)38(15-2)82-64(106)48(33(10)93)88-61(103)46-25-114-70(72)87-46/h15-17,20-22,24-26,30-35,39,45,47-49,51-53,79,92-95,108H,4-6,14,18-19,23H2,1-3,7-13H3,(H2,73,96)(H,74,97)(H,75,99)(H,76,98)(H,77,101)(H,78,105)(H,82,106)(H,88,103)(H,89,102)(H,90,104)(H,91,100)/b38-15-
InChIKey
NSFFHOGKXHRQEW-BXVAPQLOSA-N
CAS Number
CAS 1393-48-2
PubChem Compound ID
16220061
PubChem Substance ID
551660, 563007, 24900569, 57379892, 57379897, 57381275, 91702383, 103914495, 119501627, 137270267, 162091916, 162226807, 164765572, 179113936, 179149352, 179323362, 242520166
Target and Pathway
Target(s) 23S rRNA Target Info Binder [535329]
References
Ref 535329The apicoplast as an antimalarial drug target. Drug Resist Updat. 2001 Jun;4(3):145-51.
Ref 535329The apicoplast as an antimalarial drug target. Drug Resist Updat. 2001 Jun;4(3):145-51.

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