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Details

Stereochemistry ACHIRAL
Molecular Formula C14H13NO4
Molecular Weight 259.2573
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SKIMMIANINE

SMILES

COC1=CC=C2C(OC)=C3C=COC3=NC2=C1OC

InChI

InChIKey=SLSIBLKBHNKZTB-UHFFFAOYSA-N
InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3

HIDE SMILES / InChI

Molecular Formula C14H13NO4
Molecular Weight 259.2573
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Skimmianine is a newly discovered strong acetylcholinesterase (AChE) inhibitor, which can be used as promising candidate for L. braziliensis due to its potent immunomodulatory activity. In addition, because skimmianine has multi-targeted mechanism of action, it can be suggested for therapeutic efficacy in various inflammatory diseases.

Approval Year

Targets

Primary TargetPharmacologyConditionPotency

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Unknown

PubMed

Sample Use Guides

In Vivo Use Guide
at a dose of 5.0 mg/kg body weight
Route of Administration: Unknown
In Vitro Use Guide
The in vitro 50% inhibitory concentrations of y-fagarine, acidified extract, ethanol extract, skimmianine and alkaloid extract against promastigotes were determined as 8.7, 9.4, 10.9, 25.7 and 25.8 microg/mL respectively.
Substance Class Chemical
Record UNII
4E1KLC380B
Record Status Validated (UNII)
Record Version