Drug Information

Drug General Information
Drug ID
D09RZX
Former ID
DNC013152
Drug Name
CNICIN
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528414]
Structure
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2D MOL

3D MOL
Formula
C20H26O7
Canonical SMILES
CC1=CCCC(=CC2C(C(C1)OC(=O)C(=C)C(CO)O)C(=C)C(=O)O2)CO
InChI
1S/C20H26O7/c1-11-5-4-6-14(9-21)8-17-18(13(3)20(25)27-17)16(7-11)26-19(24)12(2)15(23)10-22/h5,8,15-18,21-23H,2-4,6-7,9-10H2,1H3/b11-5+,14-8-/t15?,16-,17+,18+/m0/s1
InChIKey
ZTDFZLVUIVPZDU-VANIYDICSA-N
PubChem Compound ID
442182
Target and Pathway
Target(s) UDP-N-acetylglucosamine 1-carboxyvinyltransferase Target Info Inhibitor [528414]
References
Ref 528414Bioorg Med Chem Lett. 2006 Nov 1;16(21):5605-9. Epub 2006 Aug 30.Sesquiterpene lactones are potent and irreversible inhibitors of the antibacterial target enzyme MurA.
Ref 528414Bioorg Med Chem Lett. 2006 Nov 1;16(21):5605-9. Epub 2006 Aug 30.Sesquiterpene lactones are potent and irreversible inhibitors of the antibacterial target enzyme MurA.

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