Zearalanone (Standard)

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Description

Zearalanone (Standard) is the analytical standard of Zearalanone. This product is intended for research and analytical applications. Zearalenone is a nonsteroidal estrogenic mycotoxin produced by Fusarium species, which colonizes several grains. Zearalenone has low acute toxicity and carcinogenicity. Due to its agonistic effect on the estrogen receptor, Zearalenone exhibits distinct estrogenic and anabolic properties in several animal species, resulting in severe effects on the reproductive system[1].

CAS Number

5975-78-0

UNSPSC

12352005

Target

Estrogen Receptor/ERR; Reference Standards

Type

Reference Standards

Related Pathways

Others; Vitamin D Related/Nuclear Receptor

Field of Research

Endocrinology

Assay Protocol

https://www.medchemexpress.com/zearalanone-standard.html

Smiles

O=C(O[C@@H](C)CCC1)C2=C(O)C=C(O)C=C2CCCCCC1=O

Molecular Formula

C18H24O5

Molecular Weight

320.38

References & Citations

[1]Zöllner P, et al. Triacsin Concentration levels of zearalenone and its metabolites in urine, muscle tissue, and liversamples of pigs fed with mycotoxin-contaminated oats. J Agric Food Chem. 2002 Apr 24;50 (9) :2494-501.

Shipping Conditions

Room temperature

Scientific Category

Reference Standards

Chemical Information

Zearalanone

Zearalanone is a macrolide and a member of resorcinols.

CAS Number	5975-78-0
PubChem CID	108003
IUPAC Name	(4S)-16,18-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),15,17-triene-2,8-dione
Molecular Formula	C18H24O5
Molecular Weight	320.4
XLogP	3.9
Topological Polar Surface Area	83.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Heavy Atom Count	23
Formal Charge	0
Complexity	408

SMILES

C[C@H]1CCCC(=O)CCCCCC2=C(C(=CC(=C2)O)O)C(=O)O1

InChI

InChI=1S/C18H24O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h10-12,20-21H,2-9H2,1H3/t12-/m0/s1

InChIKey

APJDQUGPCJRQRJ-LBPRGKRZSA-N

Chemical Structure

2D Structure

CAS: 5975-78-0

CID: 108003

Formula: C18H24O5

MW: 320.4

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	320.4
XLogP3	3.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	320.16237386
Monoisotopic Mass	320.16237386
Topological Polar Surface Area	83.8 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	408
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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MSS2003-01	Pribolab® Zearalanone
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Zearalanone (Standard)

Chemical Information

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