Hyaladione
AlkaPlorer ID: AK063767
Synonym: 2-Amino-3-chloro-5-(methylthio)-1,4-benzoquinone
IUPAC Name: 2-amino-3-chloro-5-methylsulfanylcyclohexa-2,5-diene-1,4-dione
Structure
SMILES: CSC1=CC(=O)C(N)=C(Cl)C1=O
InChI: InChI=1S/C7H6ClNO2S/c1-12-4-2-3(10)6(9)5(8)7(4)11/h2H,9H2,1H3
InChIKey: MFGNJGTUYKIUAR-UHFFFAOYSA-N
Reference
Hyaladione, an <i>S</i>-Methyl Cyclohexadiene-dione from <i>Hyalangium minutum</i>
PubChem CID: 57409449
LOTUS: LTS0268706
NPASS: NPC482978
COCONUT: CNP0352367
{NPAtlas: NPA013959
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hyalangium minutum | Hyalangium | Archangiaceae | Myxococcales | Myxococcia | Myxococcota | None | Bacteria |
Properties Information
Molecule Weight: 203.65
TPSA？: 60.16
MolLogP？: 0.7942
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Candida albicans | Candida albicans | MIC | 33.3 | ug.mL-1 | 10.1021/np200776v |
| Chromobacterium violaceum | Chromobacterium violaceum | MIC | 2.1 | ug.mL-1 | 10.1021/np200776v |
| Escherichia coli | Escherichia coli | MIC | 33.3 | ug.mL-1 | 10.1021/np200776v |
| Homo sapiens | HUVEC | IC50 | 2210.0 | nM | 10.1021/np200776v |
| Homo sapiens | MCF7 | IC50 | 1230.0 | nM | 10.1021/np200776v |
| Micrococcus luteus | Micrococcus luteus | MIC | 3.3 | ug.mL-1 | 10.1021/np200776v |
| Mucor hiemalis | Mucor hiemalis | MIC | 16.5 | ug.mL-1 | 10.1021/np200776v |
| Mus musculus | L929 | IC50 | 1470.0 | nM | 10.1021/np200776v |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | 8.5 | ug.mL-1 | 10.1021/np200776v |
| Rhodotorula glutinis | Rhodotorula glutinis | MIC | 1.7 | ug.mL-1 | 10.1021/np200776v |
| Schizosaccharomyces pombe | Schizosaccharomyces pombe | MIC | 33.3 | ug.mL-1 | 10.1021/np200776v |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 0.83 | ug.mL-1 | 10.1021/np200776v |
| Wickerhamomyces anomalus | Wickerhamomyces anomalus | MIC | 33.3 | ug.mL-1 | 10.1021/np200776v |
| None | NON-PROTEIN TARGET | IC50 | 3930.0 | nM | 10.1021/np200776v |
| None | NON-PROTEIN TARGET | MIC | 3.3 | ug.mL-1 | 10.1021/np200776v |