Deoxybrevianamide E
AlkaPlorer ID: AK185011
Synonym: 'L-Prolyl-2-(1,1-dimethylallyl)-L-tryptophan anhydride'
IUPAC Name: (3S,8aS)-3-[[2-[(2R)-3-methylbut-3-en-2-yl]-1H-indol-3-yl]methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: C=C(C)[C@@H](C)C1=C(C[C@@H]2N=C(O)[C@@H]3CCCN3C2=O)C2=CC=CC=C2N1
InChI: InChI=1S/C21H25N3O2/c1-12(2)13(3)19-15(14-7-4-5-8-16(14)22-19)11-17-21(26)24-10-6-9-18(24)20(25)23-17/h4-5,7-8,13,17-18,22H,1,6,9-11H2,2-3H3,(H,23,25)/t13-,17+,18+/m1/s1
InChIKey: NWQBDRIRXKLGQN-BVGQSLNGSA-N
Reference
Notoamides F−K, Prenylated Indole Alkaloids Isolated from a Marine-Derived <i>Aspergillus</i> sp.
PubChem CID: 163105300
LOTUS: LTS0226884
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Trichocomaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 351.45
TPSA？: 68.69
MolLogP？: 3.719700000000002
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|