Marinoquinoline D
AlkaPlorer ID: AK041488
Synonym: None
IUPAC Name: 4-(3H-pyrrolo[2,3-c]quinolin-4-ylmethyl)phenol
Structure
SMILES: OC1=CC=C(CC2=NC3=CC=CC=C3C3=C2NC=C3)C=C1
InChI: InChI=1S/C18H14N2O/c21-13-7-5-12(6-8-13)11-17-18-15(9-10-19-18)14-3-1-2-4-16(14)20-17/h1-10,19,21H,11H2
InChIKey: IBYIBTVYTZSSQN-UHFFFAOYSA-N
Reference
Marinoquinolines A−F, Pyrroloquinolines from <i>Ohtaekwangia kribbensis</i> (Bacteroidetes)
PubChem CID: 52952005
LOTUS: LTS0215667
NPASS: NPC324149
COCONUT: CNP0353222
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ohtaekwangia kribbensis | Ohtaekwangia | Fulvivirgaceae | Cytophagales | Cytophagia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 274.32300000000004
TPSA?: 48.91
MolLogP?: 4.012500000000003
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Electrophorus electricus | Acetylcholinesterase | IC50 | 3600.0 | nM | 10.1016/j.ejmech.2022.114206 |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1021/np100625a |
| Homo sapiens | HUVEC | IC50 | 2.5 | ug.mL-1 | 10.1021/np100625a |
| Homo sapiens | MCF7 | IC50 | 3.2 | ug.mL-1 | 10.1021/np100625a |
| Leishmania donovani | Leishmania donovani | IC50 | 119900.0 | nM | 10.1021/np100625a |
| Micrococcus luteus | Micrococcus luteus | Activity | nan | None | 10.1021/np100625a |
| Mucor hiemalis | Mucor hiemalis | Activity | nan | None | 10.1021/np100625a |
| Mus musculus | L929 | IC50 | 1.1 | ug.mL-1 | 10.1021/np100625a |
| Nocardia sp. | Nocardia sp. | Activity | nan | None | 10.1021/np100625a |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 15000.0 | nM | 10.1021/np100625a |
| Rattus norvegicus | L6 | IC50 | 66400.0 | nM | 10.1021/np100625a |
| Rhodotorula glutinis | Rhodotorula glutinis | Activity | nan | None | 10.1021/np100625a |
| Schizosaccharomyces pombe | Schizosaccharomyces pombe | Activity | nan | None | 10.1021/np100625a |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 61200.0 | nM | 10.1021/np100625a |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 27000.0 | nM | 10.1021/np100625a |
| None | NON-PROTEIN TARGET | IC50 | 3.2 | ug.mL-1 | 10.1021/np100625a |
