Eudistomidin C
AlkaPlorer ID: AK037115
Synonym: None
IUPAC Name: 5-bromo-1-[(1S)-1-(methylamino)-2-methylsulfanylethyl]-9H-pyrido[3,4-b]indol-6-ol
Structure
SMILES: CN[C@H](CSC)C1=NC=CC2=C1NC1=CC=C(O)C(Br)=C12
InChI: InChI=1S/C15H16BrN3OS/c1-17-10(7-21-2)15-14-8(5-6-18-15)12-9(19-14)3-4-11(20)13(12)16/h3-6,10,17,19-20H,7H2,1-2H3/t10-/m1/s1
InChIKey: RGJZFVKMTLBCJY-SNVBAGLBSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Vepris stolzii | Vepris | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Ascochyta fabae | Ascochyta | Didymellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 366.2840000000001
TPSA？: 60.94
MolLogP？: 3.8077000000000014
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mus musculus | L1210 | IC50 | 0.36 | ug.mL-1 | 10.1016/j.bmcl.2011.05.072 |
| Mus musculus | L1210 | IC50 | 0.36 | ug.mL-1 | 10.1016/j.ejmech.2021.113688 |
| Mus musculus | L5178Y | IC50 | 0.42 | ug.mL-1 | 10.1016/j.ejmech.2021.113688 |