Molecule

Dehydroroemerine

AlkaPlorer ID: AK054899

Synonym: Dehydroaporheine

IUPAC Name: 11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,12,14,16,18-heptaene

Structure

SMILES: CN1CCC2=C3C1=CC1=CC=CC=C1C3=C1OCOC1=C2

InChI: InChI=1S/C18H15NO2/c1-19-7-6-12-9-15-18(21-10-20-15)17-13-5-3-2-4-11(13)8-14(19)16(12)17/h2-5,8-9H,6-7,10H2,1H3

InChIKey: YUWBTKIVDAWQHK-UHFFFAOYSA-N

Reference

The Alkaloids of Stephania cepharantha HAYATA cultivated in Japan (ii)

PubChem CID: 161899

CAS: 36285-03-7

LOTUS: LTS0105471

SuperNatural Ⅲ: SN0460923

NPASS: NPC249405

COCONUT: CNP0214702

data_source: manually

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Sargassum fulvellum	Sargassum	Sargassaceae	Fucales	Phaeophyceae	None	None	Eukaryota
Papaver rhoeas	Papaver	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Stephania rotunda	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Liriodendron tulipifera	Liriodendron	Magnoliaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Papaver spicatum	Papaver	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Meiogyne baillonii	Meiogyne	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Doronicum grandiflorum	Doronicum	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	None	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Nelumbo nucifera	Nelumbo	Nelumbonaceae	Proteales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Dictyodendrilla cavernosa	Dictyodendrilla	Dictyodendrillidae	Dendroceratida	Demospongiae	Porifera	Metazoa	Eukaryota
None	Colubrina	Rhamnaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	None	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Conus gladiator	Conus	Conidae	Neogastropoda	Gastropoda	Mollusca	Metazoa	Eukaryota
Lithocarpus haipinii	Lithocarpus	Fagaceae	Fagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Sphaerophysa salsula	Sphaerophysa	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	None	Magnoliaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Oxytropis lanata	Oxytropis	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Populus balsamifera	Populus	Salicaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Euphorbia characias	Euphorbia	Euphorbiaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Stephania kwangsiensis	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Leibnitzia anandria	Leibnitzia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Stephania micrantha	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Moesziomyces antarcticus	Moesziomyces	Ustilaginaceae	Ustilaginales	Ustilaginomycetes	Basidiomycota	Fungi	Eukaryota
Papaver glaucum	Papaver	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Colubrina	Rhamnaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Stephania	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 277.323

TPSA？: 21.700000000000003

MolLogP？: 3.714000000000002

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	Neuroepithelial cell-transforming gene 1 protein	IC50	120000.0	nM	10.1021/acs.jnatprod.8b00209
Homo sapiens	Neuroepithelial cell-transforming gene 1 protein	Inhibition	83.0	%	10.1021/acs.jnatprod.8b00209
Homo sapiens	Rho guanine nucleotide exchange factor 1	Inhibition	21.0	%	10.1021/acs.jnatprod.8b00209
Plasmodium falciparum	Plasmodium falciparum	IC50	360.0	nM	10.1016/j.bmc.2009.02.050