Leucomycin A8
AlkaPlorer ID: AK036043
Synonym: None
IUPAC Name: [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] acetate
Structure
SMILES: CO[C@@H]1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(C)=O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@H]1OC(C)=O
InChI: InChI=1S/C39H63NO15/c1-21-18-27(16-17-41)35(36(48-10)29(52-25(5)42)19-30(45)49-22(2)14-12-11-13-15-28(21)44)55-38-33(46)32(40(8)9)34(23(3)51-38)54-31-20-39(7,47)37(24(4)50-31)53-26(6)43/h11-13,15,17,21-24,27-29,31-38,44,46-47H,14,16,18-20H2,1-10H3/b12-11+,15-13+/t21-,22-,23-,24+,27+,28+,29-,31+,32-,33-,34-,35+,36+,37+,38+,39-/m1/s1
InChIKey: ZGKBDJKFINKSNH-FRFMCBNZSA-N
Reference
THE CHEMISTRY OF LEUCOMYCINS. VI
PubChem CID: 5282327
LOTUS: LTS0059705
{NPAtlas: NPA020477
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces kitasatoensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 785.9250000000002
TPSA？: 206.05
MolLogP？: 1.9872000000000063
Number of H-Donors: 3
Number of H-Acceptors: 16
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus spizizenii | Bacillus spizizenii | MIC | 6.3 | ug.mL-1 | 10.1021/jm00215a025 |
| Bacteria | Bacterial 70S ribosome | IC50 | 6700.0 | nM | 10.1021/jm00215a025 |
| Bacteria | Bacterial 70S ribosome | pK50 | 5.2 | None | 10.1021/jm00215a025 |
| Klebsiella pneumoniae | Klebsiella pneumoniae | MIC | 100.0 | ug.mL-1 | 10.1021/jm00215a025 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 3.1 | ug.mL-1 | 10.1021/jm00215a025 |