Molecule

Armepavine

AlkaPlorer ID: AK013966

Synonym: '(R)-(-)-Armepavine', 'MLS000110731', 'Armepavine', '(-)-Armepavine', 'Evoeuropine', 'Alkaloid D from Evonymus europaea', 'MLSMR', 'Armepavine oxalate', 'SMR000106660'

IUPAC Name: 4-[[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]phenol

Structure

SMILES: COC1=C(OC)C=C2C(=C1)CC[NH+](C)[C@@H]2CC1=CC=C(O)C=C1

InChI: InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/p+1/t17-/m1/s1

InChIKey: ZBKFZIUKXTWQTP-QGZVFWFLSA-O

Reference

Identification and Comparison of Anti-Inflammatory Ingredients from Different Organs of Lotus Nelumbo by UPLC/Q-TOF and PCA Coupled with a NF-κB Reporter Gene Assay

PubChem CID: 6920654

LOTUS: LTS0132808

NPASS: NPC237269

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Erysimum cuspidatum	Erysimum	Brassicaceae	Brassicales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cyclopia subternata	Cyclopia	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Nelumbo nucifera	Nelumbo	Nelumbonaceae	Proteales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Papaver armeniacum	Papaver	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Parasenecio petasitoides	Parasenecio	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 314.405

TPSA？: 43.13

MolLogP？: 1.7639999999999996

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	P-glycoprotein 1	Inhibition	None	%	10.1016/j.bmc.2020.115553