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ConjuPepDB ID: cpd01365

Chemical structure


molecule
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cpd01365


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
KHK (3α,5β,7α,12α)-3,7,12-Triaminocholan-24-ol
Identification
ConjuPepDB ID

cpd01365

Smiles
Molecular weight

1571.1

Molecular formula

C78H138N24O10

Chemical name
Peptide information
Sequence (one letter)

KHK

Length

3

Peptide name

tripeptide

External ID
CAS number

786709-47-5

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

-5.88719

Rotatable bonds

52

H bond donor

22

H bond acceptor

22

Polar surface area (PSA)

602.35000

Citations
ID Title Year Authors Journal DOI

cpdart0209

Synthesis and Characterization of Peptide-Cationic Steroid Antibiotic Conjugates

2004

Ding, Bangwei; Taotofa, Uale; Orsak, Thomas; Chadwell, Matthew; Savage, Paul B.

Organic Letters

..