Glyantrypine
AlkaPlorer ID: AK053544
Synonym: None
IUPAC Name: (4R)-4-(1H-indol-3-ylmethyl)-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione
Structure
SMILES: O=C1C2=CC=CC=C2N=C2CN=C(O)[C@@H](CC3=CNC4=CC=CC=C34)N21
InChI: InChI=1S/C20H16N4O2/c25-19-17(9-12-10-21-15-7-3-1-5-13(12)15)24-18(11-22-19)23-16-8-4-2-6-14(16)20(24)26/h1-8,10,17,21H,9,11H2,(H,22,25)/t17-/m1/s1
InChIKey: YFNRNQBGKNOAPT-QGZVFWFLSA-N
Reference
Glyantrypine, a novel anthranilic acid-containing metabolite of Aspergillus clavatus
PubChem CID: 11131721
LOTUS: LTS0006306
NPASS: NPC72956
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cladosporium sp. | Cladosporium | Cladosporiaceae | Cladosporiales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 344.374
TPSA？: 83.27000000000001
MolLogP？: 3.1317000000000013
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Influenza A virus | Influenza A virus | IC50 | 100000.0 | nM | 10.1021/np400200k |