Cyclo(4-hydroxy-R-Pro-S-Leu)
AlkaPlorer ID: AK001814
Synonym: 'cyclo-(Leu-4-OH-Pro)', 'cyclo(L-Leu-Trans-4-Hydroxy-L-Pro)', 'Cyclo(4-hydroxy-R-Pro-S-Leu)', '208850-33-3', 'cyclo-(L-Leucine-L-4-hydroxyproline)', 'cyclo (L)-4-OH-Pro-(L)-Leu', '115006-86-5', 'cyclo(4-hydroxyprolinyl)isoleucine', '205648-55-1'
IUPAC Name: (3S,7R,8aS)-7-hydroxy-3-(2-methylpropyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: CC(C)C[C@@H]1N=C(O)[C@@H]2C[C@@H](O)CN2C1=O
InChI: InChI=1S/C11H18N2O3/c1-6(2)3-8-11(16)13-5-7(14)4-9(13)10(15)12-8/h6-9,14H,3-5H2,1-2H3,(H,12,15)/t7-,8+,9+/m1/s1
InChIKey: YEHIUWVXPQQDMC-VGMNWLOBSA-N
Reference
Diketopiperazines produced by an Aspergillus fumigatus Brazilian strain
PubChem CID: 21575352
LOTUS: LTS0179128
SuperNatural Ⅲ: SN0448066-06
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus fumigatus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 226.27599999999995
TPSA？: 73.13000000000001
MolLogP？: 0.3329999999999999
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 2
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 | Inhibition | 3.0 | % | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | 49.3 | % | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | nan | % | 10.1016/j.bmcl.2015.10.075 |
| Rattus norvegicus | Rattus norvegicus | Inhibition | 51.0 | % | 10.1016/j.bmcl.2015.10.075 |