Pseudellone B
AlkaPlorer ID: AK101713
Synonym: None
IUPAC Name: (1'R,3S,6'R)-3',6'-dimethylspiro[1H-indole-3,8'-7-thia-3,4-diazabicyclo[4.2.0]octane]-2,2',5'-trione
Structure
SMILES: CN1N=C(O)[C@]2(C)S[C@@]3(C(O)=NC4=CC=CC=C43)[C@@H]2C1=O
InChI: InChI=1S/C14H13N3O3S/c1-13-9(10(18)17(2)16-11(13)19)14(21-13)7-5-3-4-6-8(7)15-12(14)20/h3-6,9H,1-2H3,(H,15,20)(H,16,19)/t9-,13-,14-/m1/s1
InChIKey: ZGYVKWFYQSKYHC-OWYVNGRQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudallescheria ellipsoidea | Pseudallescheria | Microascaceae | Microascales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 303.3430000000001
TPSA？: 85.49000000000001
MolLogP？: 1.9487
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|