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Malonomicin

CAT: 0804-HY-121405Size: 1 EachDry Ice: NoHazardous: No
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Description
Malonomicin (Antibiotic K16) is an antibiotic with anti-protozoa and anti-trypanosome activities. Malonomicin also shows anti-trypanosome activity in vivo[1][2].
CAS Number
38249-71-7
Product Name Alternative
Antibiotic K16
UNSPSC
12352005
Hazard Statement
H315-H319
Target
Antibiotic; Parasite
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/malonomicin.html
Solubility
10 mM in DMSO
Smiles
O=C(C(C(O)=O)(CC(C1=C(O)[C@H](CN)NC1=O)=O)NC([C@H](CO)N)=O)O
Molecular Formula
C13H18N4O9
Molecular Weight
374.30
Precautions
P264-P280-P302+P352-P305+P351+P338-P362+P364
References & Citations
[1]Emilio L. Ghisalberti. Bioactive Tetramic Acid Metabolites. Studies in Natural Products Chemistry. Volume 28, Part I, 2003, Pages 109-163.|[2]Ottens Hendrik and Vos Cornelis. Preparation of an antibiotic for the treatment of trypanosomiasis. NL6701356. 1967.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Trypanosoma

Chemical Information

Malonomicin

Malonomicin is a dipeptide.

CAS Number38249-71-7
PubChem CID54684011
IUPAC Name2-[(2-amino-3-hydroxypropanoyl)amino]-2-[2-[2-(aminomethyl)-3-hydroxy-5-oxo-1,2-dihydropyrrol-4-yl]-2-oxoethyl]propanedioic acid
Molecular FormulaC13H18N4O9
Molecular Weight374.30
XLogP-9.1
Topological Polar Surface Area242
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Heavy Atom Count26
Formal Charge0
Complexity673
SMILES
C(C1C(=C(C(=O)N1)C(=O)CC(C(=O)O)(C(=O)O)NC(=O)C(CO)N)O)N
InChI
InChI=1S/C13H18N4O9/c14-2-5-8(20)7(10(22)16-5)6(19)1-13(11(23)24,12(25)26)17-9(21)4(15)3-18/h4-5,18,20H,1-3,14-15H2,(H,16,22)(H,17,21)(H,23,24)(H,25,26)
InChIKey
IPQOAJQXCZEYLK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Malonomicin
CAS: 38249-71-7
CID: 54684011
Formula: C13H18N4O9
MW: 374.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight374.30
XLogP3-9.1
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count9
Exact Mass374.10737816
Monoisotopic Mass374.10737816
Topological Polar Surface Area242 Ų
Heavy Atom Count26
Formal Charge0
Complexity673
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19228795-01Malonomicin

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