Asperparaline B
AlkaPlorer ID: AK032079
Synonym: None
IUPAC Name: (1S,6S,7R,9S,11S)-6,10,10,13-tetramethylspiro[3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane-11,3'-pyrrolidine]-2',5',14-trione
Structure
SMILES: C[C@H]1CCN2C[C@]34C[C@]5(CC(O)=NC5=O)C(C)(C)[C@@H]3C[C@]12C(=O)N4C
InChI: InChI=1S/C19H27N3O3/c1-11-5-6-22-10-18-9-17(8-13(23)20-14(17)24)16(2,3)12(18)7-19(11,22)15(25)21(18)4/h11-12H,5-10H2,1-4H3,(H,20,23,24)/t11-,12-,17-,18+,19+/m0/s1
InChIKey: LXDQBSJJUVATBH-IAEISPRFSA-N
Reference
New Paralytic Alkaloids, Asperparalines A, B and C, from<i>Aspergillus japonicus</i>JV-23
PubChem CID: 101007632
LOTUS: LTS0105229
{NPAtlas: NPA007196
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？: 73.21
MolLogP？: 1.6008
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|