Asperparaline C
AlkaPlorer ID: AK032087
Synonym: None
IUPAC Name: (1S,7S,9S,11S)-1',10,10,13-tetramethylspiro[3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane-11,3'-pyrrolidine]-2',5',14-trione
Structure
SMILES: CN1C(=O)C[C@]2(C[C@@]34CN5CCC[C@]5(C[C@H]3C2(C)C)C(=O)N4C)C1=O
InChI: InChI=1S/C19H27N3O3/c1-16(2)12-8-18-6-5-7-22(18)11-19(12,21(4)15(18)25)10-17(16)9-13(23)20(3)14(17)24/h12H,5-11H2,1-4H3/t12-,17-,18-,19+/m0/s1
InChIKey: OIZZXOCTAZZJQV-OZOSWLFCSA-N
Reference
New Paralytic Alkaloids, Asperparalines A, B and C, from<i>Aspergillus japonicus</i>JV-23
PubChem CID: 101007633
LOTUS: LTS0119934
SuperNatural Ⅲ: SN0266750-01
{NPAtlas: NPA004267
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus japonicus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 345.4430000000001
TPSA？: 60.93000000000001
MolLogP？: 0.8567
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|