Isoconessimine

AlkaPlorer ID: AK032071

Synonym: None

IUPAC Name: (1R,2S,5S,6S,9R,12S,13R,16S)-N,6,7,13-tetramethyl-7-azapentacyclo[10.8.0.02,9.05,9.013,18]icos-18-en-16-amine

Structure

SMILES: CN[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@@H]5[C@H](C)N(C)C[C@@]54CC[C@@H]32)C1

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InChI: InChI=1S/C23H38N2/c1-15-19-7-8-21-18-6-5-16-13-17(24-3)9-11-22(16,2)20(18)10-12-23(19,21)14-25(15)4/h5,15,17-21,24H,6-14H2,1-4H3/t15-,17-,18+,19+,20-,21-,22-,23-/m0/s1

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InChIKey: UBWOPONWVXRTKE-ALCLCTQTSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Mentha suaveolens Mentha Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Elsholtzia stauntonii Elsholtzia Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Wrightia tomentosa Wrightia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Flindersia australis Flindersia Rutaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Piper hostmannianum Piper Piperaceae Piperales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Diplospora dubia Diplospora Rubiaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Prostanthera prunelloides Prostanthera Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Funtumia elastica Funtumia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Asparagus setaceus Asparagus Asparagaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Heliotropium angiospermum Heliotropium Heliotropiaceae Boraginales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Vincetoxicum stauntonii Vincetoxicum Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Bidens parviflora Bidens Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Anisocycla grandidieri Anisocycla Menispermaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Alpinia formosana Alpinia Zingiberaceae Zingiberales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Protea compacta Protea Proteaceae Proteales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Holarrhena pubescens Holarrhena Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Pinus bungeana Pinus Pinaceae Pinales Pinopsida Streptophyta Viridiplantae Eukaryota
Typhonium flagelliforme Typhonium Araceae Alismatales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Rubus moluccanus Rubus Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Bambusa tulda Bambusa Poaceae Poales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Leucas volkensii Leucas Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Westiellopsis prolifica Westiellopsis Hapalosiphonaceae Nostocales Cyanophyceae Cyanobacteriota None Bacteria

Properties Information

Molecule Weight: 342.5710000000002

TPSA: 15.27

MolLogP: 4.467400000000004

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Entamoeba histolytica Entamoeba histolytica IC50 20.9 ug.mL-1 10.1007/s00044-011-9767-1
Plasmodium falciparum Plasmodium falciparum IC50 3390.0 nM 10.1016/j.bmcl.2005.03.021
Rattus norvegicus Rattus norvegicus Selectivity index 10.8 uM 10.1016/j.bmcl.2005.03.021
None NON-PROTEIN TARGET IC50 36550.0 nM 10.1016/j.bmcl.2005.03.021

Metabolism Information