Fellutanine B
AlkaPlorer ID: AK033699
Synonym: '(-)-Fellutanine B', 'Fellutanine B'
IUPAC Name: (3S,6S)-3-(1H-indol-3-ylmethyl)-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
Structure
SMILES: C=CC(C)(C)C1=C(C[C@@H]2N=C(O)[C@H](CC3=CNC4=CC=CC=C34)N=C2O)C2=CC=CC=C2N1
InChI: InChI=1S/C27H28N4O2/c1-4-27(2,3)24-19(18-10-6-8-12-21(18)29-24)14-23-26(33)30-22(25(32)31-23)13-16-15-28-20-11-7-5-9-17(16)20/h4-12,15,22-23,28-29H,1,13-14H2,2-3H3,(H,30,33)(H,31,32)/t22-,23-/m0/s1
InChIKey: PFYKDKMYQRWRGF-GOTSBHOMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium fellutanum | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 440.5470000000001
TPSA？: 96.76
MolLogP？: 5.561800000000003
Number of H-Donors: 4
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HeLa | Activity | None | None | 10.1021/np9903853 |
| Homo sapiens | K562 | Activity | None | None | 10.1021/np9903853 |
| Mus musculus | L929 | Activity | None | None | 10.1021/np9903853 |