1,4-Diaza-2,5-dioxobicyclo[4.3.0]nonane
AlkaPlorer ID: AK004498
Synonym: '96193-26-9', '', 'SMR000386902', 'MLS001049064', '3705-27-9', '19179-12-5', 'MLS004714430', 'Pyrrolo1,2-apyrazine-1,4-dione, hexahydro-', 'cyclo-L-Prolylglycine'
IUPAC Name: (8aS)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: O=C1CN=C(O)[C@@H]2CCCN12
InChI: InChI=1S/C7H10N2O2/c10-6-4-8-7(11)5-2-1-3-9(5)6/h5H,1-4H2,(H,8,11)/t5-/m0/s1
InChIKey: OWOHLURDBZHNGG-YFKPBYRVSA-N
Reference
PubChem CID: 126154
CAS: 3705-27-9
LOTUS: LTS0147564
SuperNatural Ⅲ: SN0277113-02
NPASS: NPC243964
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus fumigatus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| Callyspongia sp. | Callyspongia | Callyspongiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Suberites domuncula | Suberites | Suberitidae | Suberitida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 154.16899999999998
TPSA？: 52.9
MolLogP？: -0.0524999999999999
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia salina | Artemia salina | LC50 | 100.0 | ug.mL-1 | 10.1021/jf300146n |
| Bacillus spizizenii | Bacillus spizizenii | Activity | nan | None | 10.1021/np049900+ |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1021/np049900+ |
| Mus musculus | J774.A1 | Activity | nan | None | 10.1016/j.bmcl.2012.03.045 |
| Mus musculus | J774.A1 | FC | 1.29 | None | 10.1016/j.bmcl.2012.03.045 |
| Mus musculus | J774.A1 | FC | 1.86 | None | 10.1016/j.bmcl.2012.03.045 |
| Mus musculus | J774.A1 | FC | 3.5 | None | 10.1016/j.bmcl.2012.03.045 |
| Mus musculus | RAW264.7 | Activity | nan | None | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | IC50 | 4.5 | 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 | 39.7 | % | 10.1016/j.bmcl.2015.10.075 |
| Mus musculus | RAW264.7 | Inhibition | nan | % | 10.1016/j.bmcl.2015.10.075 |
| Saccharomyces cerevisiae | Saccharomyces cerevisiae | Activity | nan | None | 10.1021/np049900+ |
| Saccharomyces cerevisiae | Saccharomyces cerevisiae | Cell aggregates | 33.2 | None | 10.1021/jm049940a |
| Saccharomyces cerevisiae | Saccharomyces cerevisiae | Cell aggregates | 75.7 | None | 10.1021/jm049940a |