Budmunchiamine L5; N1,N9,N13-Tri-Me
AlkaPlorer ID: AK291132
Synonym: Budmunchiamine K
IUPAC Name: 1,9,13-trimethyl-8-pentadecyl-1,5,9,13-tetrazacycloheptadecan-6-one
Structure
SMILES: CCCCCCCCCCCCCCCC1CC(O)=NCCCN(C)CCCCN(C)CCCN1C
InChI: InChI=1S/C31H64N4O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-29-31(36)32-23-20-26-33(2)24-18-19-25-34(3)27-21-28-35(30)4/h30H,5-29H2,1-4H3,(H,32,36)
InChIKey: GSMYBFYZGNCTTL-UHFFFAOYSA-N
Reference
PubChem CID: 10097795
CAS: 178494-87-6
LOTUS: LTS0043944
NPASS: NPC479828
COCONUT: CNP0270977.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Albizia gummifera | Albizia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 508.8800000000005
TPSA？: 42.31000000000001
MolLogP？: 7.552300000000009
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia | Artemia | LC50 | 6.6 | ug.mL-1 | 10.1021/np960397d |
| Bacillus subtilis | Bacillus subtilis | IZ | 10.0 | mm | 10.1021/np960397d |
| Bacillus subtilis | Bacillus subtilis | MIC | 19.0 | ug.mL-1 | 10.1021/np960397d |
| Escherichia coli | Escherichia coli | IZ | 11.0 | mm | 10.1021/np960397d |
| Escherichia coli | Escherichia coli | MIC | 24.0 | ug.mL-1 | 10.1021/np960397d |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | IZ | 11.0 | mm | 10.1021/np960397d |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | MIC | 28.0 | ug.mL-1 | 10.1021/np960397d |
| Staphylococcus aureus | Staphylococcus aureus | IZ | 11.0 | mm | 10.1021/np960397d |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 15.0 | ug.mL-1 | 10.1021/np960397d |