Talopeptin; 4A-Epimer
AlkaPlorer ID: AK314902
Synonym: N-[N-[[(6-Deoxy-α-L-mannopyranosyl)oxy]hydroxyphosphinyl]leucyl]tryptophan, Phosphoramidon
IUPAC Name: 2-[[2-[[hydroxy-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyphosphoryl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
Structure
SMILES: CC(C)CC(NP(=O)(O)OC1OC(C)C(O)C(O)C1O)C(O)=NC(CC1=CNC2=CC=CC=C12)C(=O)O
InChI: InChI=1S/C23H34N3O10P/c1-11(2)8-16(26-37(33,34)36-23-20(29)19(28)18(27)12(3)35-23)21(30)25-17(22(31)32)9-13-10-24-15-7-5-4-6-14(13)15/h4-7,10-12,16-20,23-24,27-29H,8-9H2,1-3H3,(H,25,30)(H,31,32)(H2,26,33,34)
InChIKey: ZPHBZEQOLSRPAK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Glehnia littoralis | Glehnia | Apiaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Streptomyces tanashiensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 543.5100000000002
TPSA？: 214.16
MolLogP？: 1.0689000000000004
Number of H-Donors: 8
Number of H-Acceptors: 8
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus thermoproteolyticus | Thermolysin | Ki | 28.18 | nM | 10.1021/jm011039x |
| Homo sapiens | Angiotensin-converting enzyme | IC50 | 5.012 | nM | 10.1021/jm970211n |