Drug Information

Drug General Information
Drug ID
D03FHV
Former ID
DNC014529
Drug Name
MESUAGENIN A
Drug Type
Small molecular drug
Indication Discovery agent Investigative [531213]
Structure
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2D MOL

3D MOL
Formula
C30H32O5
Canonical SMILES
CC(C)CC(=O)C1=C(C2=C(C3=C1OC(=O)C=C3C4=CC=CC=C4)OC(C=C2<br />)(C)CCC=C(C)C)O
InChI
1S/C30H32O5/c1-18(2)10-9-14-30(5)15-13-21-27(33)26(23(31)16-19(3)4)29-25(28(21)35-30)22(17-24(32)34-29)20-11-7-6-8-12-20/h6-8,10-13,15,17,19,33H,9,14,16H2,1-5H3
InChIKey
STYQYOHXCPHKKX-UHFFFAOYSA-N
PubChem Compound ID
49870983
Target and Pathway
Target(s) Acetylcholinesterase Target Info Inhibitor [531213]
KEGG Pathway Glycerophospholipid metabolism
Cholinergic synapse
PANTHER Pathway Muscarinic acetylcholine receptor 1 and 3 signaling pathway
Muscarinic acetylcholine receptor 2 and 4 signaling pathway
Nicotinic acetylcholine receptor signaling pathway
Pathway Interaction Database ATF-2 transcription factor network
PathWhiz Pathway Phospholipid Biosynthesis
WikiPathways Monoamine Transport
Biogenic Amine Synthesis
Acetylcholine Synthesis
Integrated Pancreatic Cancer Pathway
References
Ref 531213Bioorg Med Chem. 2010 Nov 15;18(22):7873-7. Epub 2010 Sep 25.4-Phenylcoumarins from Mesua elegans with acetylcholinesterase inhibitory activity.
Ref 531213Bioorg Med Chem. 2010 Nov 15;18(22):7873-7. Epub 2010 Sep 25.4-Phenylcoumarins from Mesua elegans with acetylcholinesterase inhibitory activity.

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