Cyclo(L-Phe-L-Ala)
AlkaPlorer ID: AK028459
Synonym: None
IUPAC Name: (3S,6S)-3-benzyl-6-methylpiperazine-2,5-dione
Structure
SMILES: C[C@@H]1N=C(O)[C@H](CC2=CC=CC=C2)N=C1O
InChI: InChI=1S/C12H14N2O2/c1-8-11(15)14-10(12(16)13-8)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,13,16)(H,14,15)/t8-,10-/m0/s1
InChIKey: CNXWPOWVDIUTPS-WPRPVWTQSA-N
Reference
Diketopiperazine constituents of marine Bacillus subtilis
PubChem CID: 13783108
LOTUS: LTS0180756
SuperNatural Ⅲ: SN0050959-04
NPASS: NPC621
{NPAtlas: NPA015988
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Panax notoginseng | Panax | Araliaceae | Apiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Pinellia pedatisecta | Pinellia | Araceae | Alismatales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Nocardiopsis gilva | Nocardiopsis | Nocardiopsaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 218.256
TPSA？: 65.18
MolLogP？: 1.9128
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Fusobacterium nucleatum | Fusobacterium nucleatum | Inhibition | None | % | 10.1016/j.bmc.2018.11.042 |
| Porphyromonas gingivalis | Porphyromonas gingivalis | Inhibition | None | % | 10.1016/j.bmc.2018.11.042 |
| Streptococcus mutans | Streptococcus mutans | GI | None | None | 10.1016/j.bmc.2018.11.042 |
| Streptococcus mutans | Streptococcus mutans | Inhibition | None | % | 10.1016/j.bmc.2018.11.042 |