(-)-homoseongomycin
AlkaPlorer ID: AK073169
Synonym: None
IUPAC Name: (2R)-2-acetamido-3-(2-ethyl-4,5,9-trihydroxy-10-oxobenzo[b]fluoren-11-yl)sulfanylpropanoic acid
Structure
SMILES: CCC1=CC(O)=C2C3=C(O)C4=CC=CC(O)=C4C(=O)C3=C(SC[C@H](N=C(C)O)C(=O)O)C2=C1
InChI: InChI=1S/C24H21NO7S/c1-3-11-7-13-17(16(28)8-11)19-20(23(13)33-9-14(24(31)32)25-10(2)26)22(30)18-12(21(19)29)5-4-6-15(18)27/h4-8,14,27-29H,3,9H2,1-2H3,(H,25,26)(H,31,32)/t14-/m0/s1
InChIKey: WZRHTIAAUUTRCD-AWEZNQCLSA-N
Reference
Insights into Lomaiviticin Biosynthesis. Isolation and Structure Elucidation of (−)-Homoseongomycin
PubChem CID: 136242350
LOTUS: LTS0231353
NPASS: NPC31348
{NPAtlas: NPA015660
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pacifica | Velutinidae | Littorinimorpha | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 467.49900000000025
TPSA？: 147.64999999999998
MolLogP？: 4.170300000000003
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | MIC | 64.0 | ug.mL-1 | 10.1021/acs.jnatprod.0c00719 |
| Bacillus thuringiensis | Bacillus thuringiensis | MIC | 64.0 | ug.mL-1 | 10.1021/acs.jnatprod.0c00719 |
| Homo sapiens | HepG2 | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.0c00719 |
| Homo sapiens | MCF7 | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.0c00719 |
| Homo sapiens | SF-268 | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.0c00719 |
| Micrococcus luteus | Micrococcus luteus | MIC | 64.0 | ug.mL-1 | 10.1021/acs.jnatprod.0c00719 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 64.0 | ug.mL-1 | 10.1021/acs.jnatprod.0c00719 |