136094-36-5
AlkaPlorer ID: AK035913
Synonym: None
IUPAC Name: (4R)-11-bromo-3-methyl-4-(methylsulfanylmethyl)-1,3,6-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10(15),11,13-hexaen-12-ol
Structure
SMILES: CSC[C@H]1C2=NC=CC3=C2N(CN1C)C1=CC=C(O)C(Br)=C31
InChI: InChI=1S/C16H16BrN3OS/c1-19-8-20-10-3-4-12(21)14(17)13(10)9-5-6-18-15(16(9)20)11(19)7-22-2/h3-6,11,21H,7-8H2,1-2H3/t11-/m0/s1
InChIKey: ZEJONOQWIZODNC-NSHDSACASA-N
Reference
Eudistomidins E and F, new β-carboline alkaloids from the okinawan marine tunicate Eudistoma glaucus
PubChem CID: 638632
LOTUS: LTS0008258
SuperNatural Ⅲ: SN0468156-01
NPASS: NPC78321
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: 378.295
TPSA？: 41.290000000000006
MolLogP？: 3.964600000000003
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|