Molecule

Leuconolam

AlkaPlorer ID: AK027252

Synonym: '(-)-Leuconolam'

IUPAC Name: (12R,19S)-12-ethyl-19-hydroxy-8,16-diazatetracyclo[10.6.1.02,7.016,19]nonadeca-1(18),2,4,6-tetraene-9,17-dione

Structure

SMILES: CC[C@@]12CCCN3C(=O)C=C(C4=CC=CC=C4N=C(O)CC1)[C@]32O

InChI: InChI=1S/C19H22N2O3/c1-2-18-9-5-11-21-17(23)12-14(19(18,21)24)13-6-3-4-7-15(13)20-16(22)8-10-18/h3-4,6-7,12,24H,2,5,8-11H2,1H3,(H,20,22)/t18-,19-/m1/s1

InChIKey: OXDBJKLQCGAPQX-RTBURBONSA-N

Reference

Biologically Active Aspidofractinine Alkaloids from <i>Kopsia singapurensis</i>

PubChem CID: 14442600

LOTUS: LTS0262931

SuperNatural Ⅲ: SN0277552-03

NPASS: NPC261095

data_source: manually

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Senecio halimifolius	Senecio	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Prismatomeris sessiliflora	Prismatomeris	Rubiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Streptomyces albospinus	Streptomyces	Streptomycetaceae	Kitasatosporales	Actinomycetes	Actinomycetota	None	Bacteria
Coleus xanthanthus	Coleus	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Lethariella sernanderi	Lethariella	Parmeliaceae	Lecanorales	Lecanoromycetes	Ascomycota	Fungi	Eukaryota
Solaster endeca	Solaster	Solasteridae	Velatida	Asteroidea	Echinodermata	Metazoa	Eukaryota
Scutellaria glabrata	Scutellaria	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 326.39600000000013

TPSA？: 73.13000000000001

MolLogP？: 3.172800000000002

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Enterococcus faecalis	Enterococcus faecalis	MIC	2000.0	nM	10.1021/acs.jnatprod.6b00011
Escherichia coli	Escherichia coli	MIC	150000.0	nM	10.1021/acs.jnatprod.6b00011
Homo sapiens	MRC5	IC50	50000.0	nM	10.1021/acs.jnatprod.6b01013
Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	150000.0	nM	10.1021/acs.jnatprod.6b00011
Leishmania donovani	Leishmania donovani	Activity	nan	None	10.1021/acs.jnatprod.6b01013
Leishmania donovani	Leishmania donovani	IC50	25000.0	nM	10.1021/acs.jnatprod.6b01013
Leishmania donovani	Leishmania donovani	IC50	100000.0	nM	10.1021/acs.jnatprod.6b01013
Plasmodium falciparum	Plasmodium falciparum	IC50	100000.0	nM	10.1021/acs.jnatprod.6b01013
Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	5000.0	nM	10.1021/acs.jnatprod.6b00011
Staphylococcus aureus	Staphylococcus aureus	MIC	150000.0	nM	10.1021/acs.jnatprod.6b00011
None	ADMET	IC50	nan	nM	10.1016/S0960-894X(97)00391-0
None	Unchecked	Ratio	nan	None	10.1016/S0960-894X(97)00391-0