Brevianamide A; 5a,8a,9a-Triepimer
AlkaPlorer ID: AK290987
Synonym: Brevianamide B
IUPAC Name: 10',10'-dimethylspiro[1H-indole-2,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-2',3,14'-trione
Structure
SMILES: CC1(C)C2CC34CCCN3C(=O)C2(CC12NC1=CC=CC=C1C2=O)N=C4O
InChI: InChI=1S/C21H23N3O3/c1-18(2)14-10-19-8-5-9-24(19)17(27)20(14,23-16(19)26)11-21(18)15(25)12-6-3-4-7-13(12)22-21/h3-4,6-7,14,22H,5,8-11H2,1-2H3,(H,23,26)
InChIKey: MWOFPQAPILIIPR-UHFFFAOYSA-N
Reference
The brevianamides: a new class of fungal alkaloid
PubChem CID: 99771
CAS: 23402-09-7
LOTUS: LTS0179325
COCONUT: CNP0194043.5
{NPAtlas: NPA003674
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Chaetomium sp. | Chaetomium | Chaetomiaceae | Sordariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 365.4330000000001
TPSA？: 82.0
MolLogP？: 2.5535000000000005
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|