Nybomycin B
AlkaPlorer ID: AK003773
Synonym: None
IUPAC Name: 3,10-dimethyl-4,12-dioxo-15-oxa-3,13-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2(7),5,8,10-pentaene-6-carboxylic acid
Structure
SMILES: CC1=CC(=O)N2COC3=C2C1=CC1=C3N(C)C(=O)C=C1C(=O)O
InChI: InChI=1S/C16H12N2O5/c1-7-3-12(20)18-6-23-15-13-9(4-8(7)14(15)18)10(16(21)22)5-11(19)17(13)2/h3-5H,6H2,1-2H3,(H,21,22)
InChIKey: XROZLYMBMXXGEF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 312.28100000000006
TPSA？: 90.53
MolLogP？: 1.20992
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Escherichia coli | Escherichia coli | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Homo sapiens | A549 | EC50 | 100000.0 | nM | 10.1021/acs.jnatprod.9b01015 |
| Homo sapiens | PC-3 | EC50 | 100000.0 | nM | 10.1021/acs.jnatprod.9b01015 |
| Micrococcus luteus | Micrococcus luteus | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Mycolicibacterium aurum | Mycolicibacterium aurum | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Saccharomyces cerevisiae | Saccharomyces cerevisiae | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Salmonella enterica | Salmonella enterica | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 24.0 | ug.mL-1 | 10.1021/acs.jnatprod.9b01015 |