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Staphyloferrin A

CAT: 0013-GTR19219345-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19219345-02Size:50 mg
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Description
Staphyloferrin A is a siderophore used in research to study bacterial iron acquisition. It serves as a tool in antimicrobial research, particularly for investigating drug-resistant pathogens like Staphylococcus aureus in models of skin infection, both in vitro and in vivo.
CAS Number
127902-98-1
Field of Research
Infectious Disease & Virology
Smiles
C ([C@] (CC (O) =O) (C (O) =O) O) C (N[C@H] (CCCNC (C[C@] (CC (O) =O) (C (O) =O) O) =O) C (O) =O) =O
Molecular Formula
C17H24N2O14
Molecular Weight
480.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Butanedioic acid, 2,2'-((1-carboxy-1,4-butanediyl)bis(imino(2-oxo-2,1-ethanediyl)))bis(2-hydroxy-
CAS Number127902-98-1
PubChem CID3035516
IUPAC Name2-[2-[[4-carboxy-4-[(3,4-dicarboxy-3-hydroxybutanoyl)amino]butyl]amino]-2-oxoethyl]-2-hydroxybutanedioic acid
Molecular FormulaC17H24N2O14
Molecular Weight480.4
XLogP-4.4
Topological Polar Surface Area285
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count14
Rotatable Bond Count16
Heavy Atom Count33
Formal Charge0
Complexity812
SMILES
C(CC(C(=O)O)NC(=O)CC(CC(=O)O)(C(=O)O)O)CNC(=O)CC(CC(=O)O)(C(=O)O)O
InChI
InChI=1S/C17H24N2O14/c20-9(4-16(32,14(28)29)6-11(22)23)18-3-1-2-8(13(26)27)19-10(21)5-17(33,15(30)31)7-12(24)25/h8,32-33H,1-7H2,(H,18,20)(H,19,21)(H,22,23)(H,24,25)(H,26,27)(H,28,29)(H,30,31)
InChIKey
VJSIXUQLTJCRCS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butanedioic acid, 2,2'-((1-carboxy-1,4-butanediyl)bis(imino(2-oxo-2,1-ethanediyl)))bis(2-hydroxy-
CAS: 127902-98-1
CID: 3035516
Formula: C17H24N2O14
MW: 480.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight480.4
XLogP3-4.4
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count14
Rotatable Bond Count16
Exact Mass480.12275344
Monoisotopic Mass480.12275344
Topological Polar Surface Area285 Ų
Heavy Atom Count33
Formal Charge0
Complexity812
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N11874-01Staphyloferrin A

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