Macrophilone F
AlkaPlorer ID: AK149861
Synonym: None
IUPAC Name: 3-thia-6,10,15-triazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(15),2(7),8,10,12(16)-pentaen-8-ol
Structure
SMILES: O=C1C2=C(SCCN2)C2=NCCC3=CNC1=C23
InChI: InChI=1S/C12H11N3OS/c16-11-8-7-6(5-15-8)1-2-13-9(7)12-10(11)14-3-4-17-12/h5,14-15H,1-4H2
InChIKey: NUSOEZFPTUYFNJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Macrorhynchia philippina | Macrorhynchia | Aglaopheniidae | Leptothecata | Hydrozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 245.307
TPSA？: 57.25
MolLogP？: 1.1041999999999998
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Small ubiquitin-related modifier 1 | IC50 | 100000.0 | nM | 10.1021/acs.jnatprod.8b00343 |