Asperlicin D; (S)-form
AlkaPlorer ID: AK289489
Synonym: None
IUPAC Name: 7-(1H-indol-3-ylmethyl)-5,7-dihydroquinazolino[3,2-d][1,4]benzodiazepine-6,9-dione
Structure
SMILES: O=C1C2=CC=CC=C2N=C2C3=CC=CC=C3N=C(O)C(CC3=CNC4=CC=CC=C34)N21
InChI: InChI=1S/C25H18N4O2/c30-24-22(13-15-14-26-19-10-4-1-7-16(15)19)29-23(17-8-2-5-11-20(17)28-24)27-21-12-6-3-9-18(21)25(29)31/h1-12,14,22,26H,13H2,(H,28,30)
InChIKey: TTYFXJZDLYVOTG-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus alliaceus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 406.4450000000001
TPSA？: 83.27000000000001
MolLogP？: 4.930200000000003
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|