Drug Information

Drug General Information
Drug ID
D0AU4H
Former ID
DNC002950
Drug Name
Thiamin Diphosphate
Drug Type
Small molecular drug
Indication Discovery agent Investigative [551393]
Structure
Download
2D MOL

3D MOL
Formula
C12H17N4O7P2S-
Canonical SMILES
CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)([O-])OP(=O)(O)[<br />O-]
InChI
1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p-1
InChIKey
AYEKOFBPNLCAJY-UHFFFAOYSA-M
CAS Number
CAS 154-87-0
PubChem Compound ID
6518189
PubChem Substance ID
10852057, 24775655, 43173860, 46391358, 53739203, 56225886, 56269940, 57370861, 114621535
Target and Pathway
Target(s) DNA Target Info Inhibitor [551393]
References
Ref 551393How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6.
Ref 551393How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6.

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