Trans-cyclo-(D-tryptophanyl-L-tyrosyl)
AlkaPlorer ID: AK050753
Synonym: None
IUPAC Name: (3S,6R)-3-[(4-hydroxyphenyl)methyl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione
Structure
SMILES: O=C1N[C@H](CC2=CNC3=CC=CC=C23)C(=O)N[C@H]1CC1=CC=C(O)C=C1
InChI: InChI=1S/C20H19N3O3/c24-14-7-5-12(6-8-14)9-17-19(25)23-18(20(26)22-17)10-13-11-21-16-4-2-1-3-15(13)16/h1-8,11,17-18,21,24H,9-10H2,(H,22,26)(H,23,25)/t17-,18+/m0/s1
InChIKey: ZJDMXAAEAVGGSK-ZWKOTPCHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus fumigatus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| None | Microbispora | Streptosporangiaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 349.3900000000001
TPSA？: 94.22
MolLogP？: 1.6418999999999997
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | Unchecked | Activity | nan | None | 10.1021/np800501m |
| None | Unchecked | Kcat | 0.46 | /s | 10.1021/np800501m |
| None | Unchecked | Km | 128.0 | nM | 10.1021/np800501m |
| None | Unchecked | Ratio | 598.0 | None | 10.1021/np800501m |