Lynamicin A
AlkaPlorer ID: AK037330
Synonym: None
IUPAC Name: methyl 3,4-bis(5-chloro-1H-indol-3-yl)-1H-pyrrole-2-carboxylate
Structure
SMILES: COC(=O)C1=C(C2=CNC3=CC=C(Cl)C=C23)C(C2=CNC3=CC=C(Cl)C=C23)=CN1
InChI: InChI=1S/C22H15Cl2N3O2/c1-29-22(28)21-20(16-9-26-19-5-3-12(24)7-14(16)19)17(10-27-21)15-8-25-18-4-2-11(23)6-13(15)18/h2-10,25-27H,1H3
InChIKey: ADBVWUJBUGOHJH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Actinomycetaceae | Actinomycetales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 424.2870000000001
TPSA？: 73.67
MolLogP？: 6.404700000000003
Number of H-Donors: 3
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Enterococcus faecalis | Enterococcus faecalis | MIC | 19000.0 | nM | 10.1021/np800286d |
| Enterococcus faecium | Enterococcus faecium | MIC | 19000.0 | nM | 10.1021/np800286d |
| Escherichia coli | Escherichia coli | MIC | 16000.0 | nM | 10.1021/np800286d |
| Haemophilus influenzae | Haemophilus influenzae | MIC | 28000.0 | nM | 10.1021/np800286d |
| Haemophilus influenzae | Haemophilus influenzae | MIC | 38000.0 | nM | 10.1021/np800286d |
| Herpesviridae sp. | Herpesviridae sp. | IC50 | 17.2 | ug.mL-1 | 10.1021/np800286d |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 4300.0 | nM | 10.1021/np800286d |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 4700.0 | nM | 10.1021/np800286d |
| Staphylococcus epidermidis | Staphylococcus epidermidis | MIC | 9500.0 | nM | 10.1021/np800286d |
| Streptococcus pneumoniae | Streptococcus pneumoniae | MIC | 57000.0 | nM | 10.1021/np800286d |