Molecule

Cyclo-(L-Ala-trans-4-hydroxy-L-Pro)

AlkaPlorer ID: AK039622

Synonym: None

IUPAC Name: (3S,7R,8aS)-7-hydroxy-3-methyl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

SMILES: C[C@@H]1NC(=O)[C@@H]2C[C@@H](O)CN2C1=O

InChI: InChI=1S/C8H12N2O3/c1-4-8(13)10-3-5(11)2-6(10)7(12)9-4/h4-6,11H,2-3H2,1H3,(H,9,12)/t4-,5+,6-/m0/s1

InChIKey: JBVUOARNEYAAOS-JKUQZMGJSA-N

PubChem CID: 21580253

LOTUS: LTS0126376

SuperNatural Ⅲ: SN0161292-01

NPASS: NPC126186

{

NPAtlas: NPA004095

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Aspergillus fumigatus	Aspergillus	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Pseudomonas brassicacearum	Pseudomonas	Pseudomonadaceae	Pseudomonadales	Gammaproteobacteria	Pseudomonadota	None	Bacteria
Callyspongia sp.	Callyspongia	Callyspongiidae	Haplosclerida	Demospongiae	Porifera	Metazoa	Eukaryota
Suberites domuncula	Suberites	Suberitidae	Suberitida	Demospongiae	Porifera	Metazoa	Eukaryota

Molecule Weight: 184.195

TPSA？: 69.64

MolLogP？: -1.5335

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 2

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Artemia salina	Artemia salina	LC50	66.1	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	FC	1.12	None	10.1016/j.bmcl.2012.03.045
Mus musculus	J774.A1	FC	1.65	None	10.1016/j.bmcl.2012.03.045
Mus musculus	J774.A1	FC	3.09	None	10.1016/j.bmcl.2012.03.045
Mus musculus	J774.A1	FC	4.49	None	10.1016/j.bmcl.2012.03.045
Saccharomyces cerevisiae	Saccharomyces cerevisiae	Activity	nan	None	10.1021/np049900+