Didebromodiscorhabdin C
AlkaPlorer ID: AK104835
Synonym: None
IUPAC Name: 8-hydroxyspiro[6,10,15-triazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(15),2(7),8,10,12(16)-pentaene-3,4'-cyclohexa-2,5-diene]-1'-one
Structure
SMILES: O=C1C=CC2(C=C1)CCNC1=C2C2=NCCC3=CNC(=C23)C1=O
InChI: InChI=1S/C18H15N3O2/c22-11-1-4-18(5-2-11)6-8-20-16-13(18)14-12-10(3-7-19-14)9-21-15(12)17(16)23/h1-2,4-5,9,20-21H,3,6-8H2
InChIKey: AROYJUCVKLJDAK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Sceptrella | Latrunculiidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 305.33700000000005
TPSA？: 74.32
MolLogP？: 1.4851
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |
| Escherichia coli | Escherichia coli | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |
| Homo sapiens | K562 | IC50 | 21000.0 | nM | 10.1021/np9005629 |
| Micrococcus luteus | Micrococcus luteus | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |
| Proteus vulgaris | Proteus vulgaris | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |
| Salmonella enterica | Salmonella enterica | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |
| Staphylococcus aureus | Sortase A | IC50 | 127400.0 | nM | 10.1021/np9005629 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 100.0 | ug.mL-1 | 10.1021/np9005629 |