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Pyoluteorin

CAT: 1299-RM-P251500-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-P251500-03Size:50 mg
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CAS Number
25683-07-2
Synonyms
(4,5-dichloro-1H-pyrrol-2-yl) (2,6-dihydroxyphenyl) methanone
Molecular Formula
C11H7Cl2NO3
Molecular Weight
272.08
Target Alternative Name
Pyoluteorin
Product Name Synonym
(4,5-dichloro-1H-pyrrol-2-yl) (2,6-dihydroxyphenyl) methanone

Chemical Information

Pyoluteorin

Pyoluteorin is a member of the class of resorcinols that is resorcinol in which the hydrogen at position 2 is replaced by a 4,5-dichloro-1H-pyrrole-2-carbonyl group. It is a natural product found in Pseudomonas fluorescens which exhibits antibacterial properties and is a strong inducer of caspase-3-dependent apoptosis. It has a role as an antibacterial agent, an antifungal agent, an apoptosis inducer, a marine metabolite and a bacterial metabolite. It is a diol, a polyketide, a member of pyrroles, a member of resorcinols, an organochlorine compound, an organochlorine pesticide, a beta-hydroxy ketone and an aromatic ketone.

CAS Number25683-07-2
PubChem CID33137
IUPAC Name(4,5-dichloro-1H-pyrrol-2-yl)-(2,6-dihydroxyphenyl)methanone
Molecular FormulaC11H7Cl2NO3
Molecular Weight272.08
XLogP3.8
Topological Polar Surface Area73.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity292
SMILES
C1=CC(=C(C(=C1)O)C(=O)C2=CC(=C(N2)Cl)Cl)O
InChI
InChI=1S/C11H7Cl2NO3/c12-5-4-6(14-11(5)13)10(17)9-7(15)2-1-3-8(9)16/h1-4,14-16H
InChIKey
JPGWTZORMBTNMF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyoluteorin
CAS: 25683-07-2
CID: 33137
Formula: C11H7Cl2NO3
MW: 272.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight272.08
XLogP33.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass270.9802985
Monoisotopic Mass270.9802985
Topological Polar Surface Area73.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity292
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
558450Pyoluteorin

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