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Citrinin structure, CAS 518-75-2

Citrinin

CAS Number518-75-2

Synonyms(3R,4S)-8-Hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid; 4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-isochromene-7-carboxylic acid; Citriain; Citrinin; Cytrinine; (3R,4S)-4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-2-benzopyran-7-carboxylic acid; citrinin,antimycin; CIT; (-)-Citrinin; MFCD00006912; ,(3r-trans); EINECS 208-257-2

Molecular FormulaC13H14O5

Molecular Weight250.25

Purity98%

Density1.4±0.1 g/cm3

Boiling Point409.8±45.0 °C at 760 mmHg

Melting Point175°C (dec.)

Flash Point

AppearanceYellow powder, crystal or flake

EINECS200-835-2

MSDSChineseEnglish

Symbol6.1(a)

Signal WordWarning

Cat. No.: 2A-9009824 Purity: 98%
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Quality Control of [ 518-75-2 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number518-75-2
Catalog No.2A-9009824
Chinese Name橘霉素
Synonyms(3R,4S)-8-Hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid; 4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-isochromene-7-carboxylic acid; Citriain; Citrinin; Cytrinine; (3R,4S)-4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-2-benzopyran-7-carboxylic acid; citrinin,antimycin; CIT; (-)-Citrinin; MFCD00006912; ,(3r-trans); EINECS 208-257-2
Molecular FormulaC13H14O5
Molecular Weight250.25
Purity98
Density1.4±0.1 g/cm3
Boiling Point409.8±45.0 °C at 760 mmHg
Melting Point175°C (dec.)
AppearanceYellow powder, crystal or flake
Storage Condition1. Store in a cool, dry and well-ventilated wareho
PackagingII
ApplicationCitrinin is a mycotoxin that causes food contamination and has diverse toxic effects. Citrinin is often found together with Ochratoxin A, another nephrotoxic mycotoxin. Citrinin has been reported to h
EINECS200-835-2
PubChem ID329755166
MDL NumberMFCD00006912
SMILESC[C@H]1OC=C2C(O)=C(C(O)=O)C(=O)C(C)=C2[C@@H]1C
InChI1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,15H,1-3H3,(H,16,17)/t5-,7-/m1/s1
InChI KeyCQIUKKVOEOPUDV-IYSWYEEDSA-N
NACRES CodeNA.24
UNSPSC85151701
Hazard Symbols6.1(a)
MSDSmsds/9824_1_518_75_2.pdf
BioactivityCitrinin is a mycotoxin which causes contamination in the food and is associated with different toxic effects. Citrinin is usually found together with another nephrotoxic mycotoxin, Ochratoxin A. Citrinin is also reported to possess a broad spectrum of bioactivities, including antibacterial, antifungal, and potential anticancer and neuro-protective effects in vitro[1][2]. Related Catalog Research Areas >> Cancer Research Areas >> Infection Signaling Pathways >> Anti-infection >> Fungal Research Areas >> Neurological Disease Signaling Pathways >> Anti-infection >> Bacterial References [1]. de Oliveira Filho JWG, et al, A comprehensive review on biological properties of citrinin. Food Chem Toxicol. 2017 Dec;110:130-141. [2]. Čulig B, et al. PRESENCE OF CITRININ IN GRAINS AND ITS POSSIBLE HEALTH EFFECTS. Afr J Tradit Complement Altern Med. 2017 Mar 1;14(3):22-30 Chemical & Physical Properties Density 1.4±0.1 g/cm3 Boiling Point 409.8±45.0 °C at 760 mmHg Melting Point 175°C (dec.) Molecular Formula C13H14O5 Molecular Weight 250.247 Flash Point 156.6±22.2 °C Exact Mass 250.084122 PSA 83.83000 LogP 1.20 Vapour Pressure 0.0±2.2 mmHg at 25°C Index of Refraction 1.596 InChIKey CBGDIJWINPWWJW-IYSWYEEDSA-N SMILES CC1=C2C(=COC(C)C2C)C(=O)C(C(=O)O)=C1O
Use ofCitrinin is a mycotoxin which causes contamination in the food and is associated with different toxic effects. Citrinin is usually found together with another nephrotoxic mycotoxin, Ochratoxin A. Citrinin is also reported to possess a broad spectrum of bioactivities, including antibacterial, antifungal, and potential anticancer and neuro-protective effects in vitro[1][2]. Properties Articles45 Name (-)-citrinin Synonym More Synonyms (-)-Citrinin Biological Activity Description Citrinin is a mycotoxin which causes contamination in the food and is associated with different toxic effects. Citrinin is usually found together with another nephrotoxic mycotoxin, Ochratoxin A. Citrinin is also reported to possess a broad spectrum of bioactivities, including antibacterial, antifungal, and potential anticancer and neuro-protective effects in vitro[1][2]. Related Catalog Research Areas >> Cancer Research Areas >> Infection Signaling Pathways >> Anti-infection >> Fungal Research Areas >> Neurological Disease Signaling Pathways >> Anti-infection >> Bacterial References [1]. de Oliveira Filho JWG, et al, A comprehensive review on biological properties of citrinin. Food Chem Toxicol. 2017 Dec;110:130-141. [2]. Čulig B, et al. PRESENCE OF CITRININ IN GRAINS AND ITS POSSIBLE HEALTH EFFECTS. Afr J Tradit Complement Altern Med. 2017 Mar 1;14(3):22-30 Chemical & Physical Properties Molecular Formula C13H14O5 Exact Mass 250.084122 PSA 83.83000 Index of Refraction 1.596 InChIKey CBGDIJWINPWWJW-IYSWYEEDSA-N
Transport InfoProduct name: Citrinin
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