Budmunchiamine L4; 6'-Hydroxy, N1,N9,N13-tri-Me
AlkaPlorer ID: AK291126
Synonym: 6'-Hydroxybudmunchiamine C
IUPAC Name: 8-(6-hydroxytridecyl)-1,9,13-trimethyl-1,5,9,13-tetrazacycloheptadecan-6-one
Structure
SMILES: CCCCCCCC(O)CCCCCC1CC(O)=NCCCN(C)CCCCN(C)CCCN1C
InChI: InChI=1S/C29H60N4O2/c1-5-6-7-8-11-18-28(34)19-12-9-10-17-27-26-29(35)30-20-15-23-31(2)21-13-14-22-32(3)24-16-25-33(27)4/h27-28,34H,5-26H2,1-4H3,(H,30,35)
InChIKey: QWFMMZFSRPWZQB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Albizia gummifera | Albizia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 496.8250000000005
TPSA？: 62.540000000000006
MolLogP？: 5.742900000000006
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia | Artemia | LC50 | 79.7 | ug.mL-1 | 10.1021/np960397d |
| Bacillus subtilis | Bacillus subtilis | IZ | 8.0 | mm | 10.1021/np960397d |
| Bacillus subtilis | Bacillus subtilis | MIC | 45.0 | ug.mL-1 | 10.1021/np960397d |
| Escherichia coli | Escherichia coli | IZ | 7.0 | mm | 10.1021/np960397d |
| Escherichia coli | Escherichia coli | MIC | 72.0 | ug.mL-1 | 10.1021/np960397d |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | IZ | 7.0 | mm | 10.1021/np960397d |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | 84.0 | ug.mL-1 | 10.1021/np960397d |
| Staphylococcus aureus | Staphylococcus aureus | IZ | 8.0 | mm | 10.1021/np960397d |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 35.0 | ug.mL-1 | 10.1021/np960397d |