Cyclo-(L-phenylalanyl-4R-hydroxy-L-proline)
AlkaPlorer ID: AK016706
Synonym: None
IUPAC Name: (3S,7R,8aS)-3-benzyl-7-hydroxy-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: O=C1[C@H](CC2=CC=CC=C2)N=C(O)[C@@H]2C[C@@H](O)CN12
InChI: InChI=1S/C14H16N2O3/c17-10-7-12-13(18)15-11(14(19)16(12)8-10)6-9-4-2-1-3-5-9/h1-5,10-12,17H,6-8H2,(H,15,18)/t10-,11+,12+/m1/s1
InChIKey: PYQJYHACQOBZLF-WOPDTQHZSA-N
Reference
Diketopiperazines produced by an Aspergillus fumigatus Brazilian strain
PubChem CID: 10467786
CAS: 118477-06-8
LOTUS: LTS0026623
SuperNatural Ⅲ: SN0298675-06
{NPAtlas: NPA009811
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudoalteromonas luteoviolacea | Pseudoalteromonas | Pseudoalteromonadaceae | Alteromonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 260.29299999999995
TPSA？: 73.13
MolLogP？: 0.5295999999999998
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Dengue virus | Dengue virus | EC50 | 11200.0 | nM | 10.1016/j.ejmech.2019.05.010 |
| Mus musculus | RAW264.7 | Activity | nan | None | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | IC50 | 14.2 | ug.mL-1 | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | 3.0 | % | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | 43.5 | % | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | nan | % | 10.1016/j.bmcl.2015.10.075 |
| None | Unchecked | Inhibition | nan | % | 10.1016/j.bmcl.2016.09.021 |