Aplyzanzine A
AlkaPlorer ID: AK041867
Synonym: ''
IUPAC Name: (2S)-N-[2-[3,5-dibromo-4-[3-(dimethylamino)propoxy]phenyl]ethyl]-3-(3,5-dibromo-4-methoxyphenyl)-2-(dimethylamino)propanamide
Structure
SMILES: COC1=C(Br)C=C(C[C@@H](C(O)=NCCC2=CC(Br)=C(OCCCN(C)C)C(Br)=C2)N(C)C)C=C1Br
InChI: InChI=1S/C25H33Br4N3O3/c1-31(2)9-6-10-35-24-20(28)11-16(12-21(24)29)7-8-30-25(33)22(32(3)4)15-17-13-18(26)23(34-5)19(27)14-17/h11-14,22H,6-10,15H2,1-5H3,(H,30,33)/t22-/m0/s1
InChIKey: OZOVQXJIZUQCKN-QFIPXVFZSA-N
Reference
Aplyzanzine A, a New Dibromotyrosine Derivative from a Verongida Sponge
PubChem CID: 60153165
LOTUS: LTS0221688
SuperNatural Ⅲ: SN0279403-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Aplysinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 743.1730000000001
TPSA？: 57.53
MolLogP？: 6.747600000000007
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Acinetobacter baumannii | Acinetobacter baumannii | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Bacillus subtilis | Bacillus subtilis | MIC | 16000.0 | ug.mL-1 | 10.1021/np300102z |
| Burkholderia cepacia | Burkholderia cepacia | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Candida albicans | Candida albicans | MIC | 64000.0 | ug.mL-1 | 10.1021/np300102z |
| Enterobacter cloacae | Enterobacter cloacae | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Enterococcus faecalis | Enterococcus faecalis | MIC | 32000.0 | ug.mL-1 | 10.1021/np300102z |
| Enterococcus faecium | Enterococcus faecium | MIC | 32000.0 | ug.mL-1 | 10.1021/np300102z |
| Escherichia coli | Escherichia coli | MIC | 32000.0 | ug.mL-1 | 10.1021/np300102z |
| Klebsiella pneumoniae | Klebsiella pneumoniae | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Listeria monocytogenes | Listeria monocytogenes | MIC | 32000.0 | ug.mL-1 | 10.1021/np300102z |
| Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | 25.0 | ug.mL-1 | 10.1021/np300102z |
| Nakaseomyces glabratus | Nakaseomyces glabratus | MIC | 64000.0 | ug.mL-1 | 10.1021/np300102z |
| Providencia rettgeri | Providencia rettgeri | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Salmonella enterica subsp. enterica serovar Typhimurium | Salmonella typhimurium | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Serratia marcescens | Serratia marcescens | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 32000.0 | ug.mL-1 | 10.1021/np300102z |
| Staphylococcus epidermidis | Staphylococcus epidermidis | MIC | 16000.0 | ug.mL-1 | 10.1021/np300102z |
| Streptococcus pyogenes | Streptococcus pyogenes | MIC | 16000.0 | ug.mL-1 | 10.1021/np300102z |
| Yersinia enterocolitica | Yersinia enterocolitica | MIC | 128000.0 | ug.mL-1 | 10.1021/np300102z |