Patulin structure, CAS 149-29-1

Patulin

CAS Number149-29-1

Synonyms(2,4-Dihydroxy-2H-pyran-3(6H)-ylidene)acetic Acid 3,4-Lactone; DL-Patulin; Mycoin C3; 4-Hydroxy-4H-furo[3,2-c]pyran-2(6H)-one,PAT; Clavacin; MFCD00005858; Expansin; Claviformin; Penicidin; Clairformin; Patulin; 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one; Leucopin; EINECS 205-735-2; gigantin; Clavatin; UNII:95X2BV4W8R; Expansine; Patuline; Claviform; 4-Hydroxy-4H-furo[3,2-c]pyran-2(6H)-one

Molecular FormulaC7H6O4

Molecular Weight154.120

Purity98%

Density1.5±0.1 g/cm3

Boiling Point513.7±50.0 °C at 760 mmHg

Melting Point108-111 °C

Flash Point

AppearanceWhite crystal

EINECS

MSDSChineseEnglish

Symbol6.1(a)

Signal WordWarning

Cat. No.: 2A-1169468 Purity: 98%
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Chemical & Physical Properties
CAS Number149-29-1
Catalog No.2A-1169468
Chinese Name棒曲霉素
Synonyms(2,4-Dihydroxy-2H-pyran-3(6H)-ylidene)acetic Acid 3,4-Lactone; DL-Patulin; Mycoin C3; 4-Hydroxy-4H-furo[3,2-c]pyran-2(6H)-one,PAT; Clavacin; MFCD00005858; Expansin; Claviformin; Penicidin; Clairformin; Patulin; 4-hydroxy-4,6-dihydrofuro[3,2-c]pyran-2-one; Leucopin; EINECS 205-735-2; gigantin; Clavatin; UNII:95X2BV4W8R; Expansine; Patuline; Claviform; 4-Hydroxy-4H-furo[3,2-c]pyran-2(6H)-one
Molecular FormulaC7H6O4
Molecular Weight154.120
Purity98
Density1.5±0.1 g/cm3
Boiling Point513.7±50.0 °C at 760 mmHg
Melting Point108-111 °C
AppearanceWhite crystal
Storage ConditionStore at -18ºC.
PackagingI
ApplicationPatulin (Terinin) is a mycotoxin produced by several fungal genera such as Aspergillus, Penicillium and Byssochlamys. It is believed to cause chromosome fragmentation, mutagenesis, teratogenesis and c
SMILESO=C1C=C2C(=CCOC2O)O1
InChIInChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2
InChI KeyZRWPUFFVAOMMNM-UHFFFAOYSA-N
Hazard Symbols6.1(a)
BioactivityPatulin (Terinin) is a mycotoxin produced by fungi including the Aspergillus, Penicillium, and Byssochlamys species, is suspected to be clastogenic, mutagenic, teratogenic and cytotoxic. Patulin (Terinin) induces autophagy-dependent apoptosis through lysosomal-mitochondrial axis, and causes DNA damage[1][2][3][4]. Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Research Areas >> Others References [1]. Puel O, et al. Biosynthesis and toxicological effects of patulin. Toxins (Basel). 2010 Apr;2(4):613-31. [2]. Hayes AW, et al. Acute toxicity of patulin in mice and rats. Toxicology. 1979 Jun-Jul;13(2):91-100. [3]. Glaser N, et al. Patulin: Mechanism of genotoxicity. Food Chem Toxicol. 2012 May;50(5):1796-801. [4]. Sun M, et al. Patulin Induces Autophagy-Dependent Apoptosis through Lysosomal-Mitochondrial Axis and Impaired Mitophagy in HepG2 Cells. J Agric Food Chem. 2018 Nov 21;66(46):12376-12384. Chemical & Physical Properties Density 1.5±0.1 g/cm3 Boiling Point 513.7±50.0 °C at 760 mmHg Melting Point 108-111 °C Molecular Formula C7H6O4 Molecular Weight 154.120 Flash Point 226.8±23.6 °C Exact Mass 154.026611 PSA 55.76000 LogP -0.75 Vapour Pressure 0.0±3.0 mmHg at 25°C Index of Refraction 1.603 InChIKey ZRWPUFFVAOMMNM-UHFFFAOYSA-N SMILES O=C1C=C2C(=CCOC2O)O1
Use ofPatulin (Terinin) is a mycotoxin produced by fungi including the Aspergillus, Penicillium, and Byssochlamys species, is suspected to be clastogenic, mutagenic, teratogenic and cytotoxic. Patulin (Terinin) induces autophagy-dependent apoptosis through lysosomal-mitochondrial axis, and causes DNA damage[1][2][3][4]. Properties Articles64 Name patulin Synonym More Synonyms Patulin Biological Activity Description Patulin (Terinin) is a mycotoxin produced by fungi including the Aspergillus, Penicillium, and Byssochlamys species, is suspected to be clastogenic, mutagenic, teratogenic and cytotoxic. Patulin (Terinin) induces autophagy-dependent apoptosis through lysosomal-mitochondrial axis, and causes DNA damage[1][2][3][4]. Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Research Areas >> Others References [1]. Puel O, et al. Biosynthesis and toxicological effects of patulin. Toxins (Basel). 2010 Apr;2(4):613-31. [2]. Hayes AW, et al. Acute toxicity of patulin in mice and rats. Toxicology. 1979 Jun-Jul;13(2):91-100. [3]. Glaser N, et al. Patulin: Mechanism of genotoxicity. Food Chem Toxicol. 2012 May;50(5):1796-801. Chemical & Physical Properties Molecular Formula C7H6O4 Exact Mass 154.026611 PSA 55.76000 LogP -0.75 Index of Refraction 1.603 InChIKey ZRWPUFFVAOMMNM-UHFFFAOYSA-N
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Danger Regulations: 3462 International Maritime Transport Danger Regulations: 3462 International Air Transport Danger Regulations: 3462 14.2 United Nations shipping name European Land Transport Dangerous Regulations: TOXINS EXTRAC TED FROM LIVING SOURCES, SOLID, N.O.S. IMDG: TOXINS, EXTRACTED FROM LIVING SOURCES, SOLID, N.O.S. International air transport hazard regulations: Toxins, extracted from living sources, solid, n.o.s. 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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