Cyclo(D)-Pro-(D)-Ile
AlkaPlorer ID: AK036088
Synonym: None
IUPAC Name: (3R,8aR)-3-[(2R)-butan-2-yl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: CC[C@@H](C)[C@H]1N=C(O)[C@H]2CCCN2C1=O
InChI: InChI=1S/C11H18N2O2/c1-3-7(2)9-11(15)13-6-4-5-8(13)10(14)12-9/h7-9H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-/m1/s1
InChIKey: ZDACRNZBFJOLTC-IWSPIJDZSA-N
Reference
PubChem CID: 44566897
LOTUS: LTS0066507
SuperNatural Ⅲ: SN0467107-06
NPASS: NPC209156
{NPAtlas: NPA004554
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Bombyx mori | Bombyx | Bombycidae | Lepidoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
| Pecten maximus | Pecten | Pectinidae | Pectinida | Bivalvia | Mollusca | Metazoa | Eukaryota |
| Vibrio anguillarum | Vibrio | Vibrionaceae | Vibrionales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 210.277
TPSA？: 52.900000000000006
MolLogP？: 1.3622
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Vibrio anguillarum | Vibrio anguillarum | MIC | 0.05 | ug.mL-1 | 10.1021/np030233e |