3D model is for representation purpose only.
.
.
MWK | (3α,5β,7α,12α)-3,7,12-Triaminocholan-24-ol |
Identification | |
---|---|
ConjuPepDB ID | cpd01366 |
Smiles | |
Inchi Key | InChIKey=KHOOJWQLGLXNCZ-UHFFFAOYSA-N |
Molecular weight | 1727 |
Molecular formula | C90H138N18O10S3 |
Chemical name | Peptide information |
Sequence (one letter) | MWK |
Length | 3 |
Peptide name | tripeptide |
External ID | |
---|---|
CAS number | 786709-46-4 |
Other information | |
---|---|
Application | Antibiotic, antibacterial |
Pharmacological class | antimicrobial, antibacterial |
Conjugate type | amide |
Linker | no |
Small molecule | (3α,5β,7α,12α)-3,7,12-Triaminocholan-24-ol |
Small molecule CAS | 222165-77-7 |
Structure method | 1H- and 13C NMR |
Calculated properties | |
---|---|
LogP | 4.04059 |
Rotatable bonds | 49 |
H bond donor | 19 |
H bond acceptor | 16 |
Polar surface area (PSA) | 485.62000 |
Citations | |||||
---|---|---|---|---|---|
ID | Title | Year | Authors | Journal | DOI |
Synthesis and Characterization of Peptide-Cationic Steroid Antibiotic Conjugates | 2004 | Ding, Bangwei; Taotofa, Uale; Orsak, Thomas; Chadwell, Matthew; Savage, Paul B. | Organic Letters |