Anthocyanin structure, CAS 528-53-0

Anthocyanin

CAS Number528-53-0

SynonymsT66 BOJ CR CQ DQ DQ& GQ IQ &&Chloride; 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol,chloride; 3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium chloride; Delphinidin chloride; 3,3',4',5,5',7-hexahydroxy-2-phenylbenzopyrylium chloride; 1-Benzopyrylium, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-, chloride (1:1)

Molecular FormulaC15H11ClO7

Molecular Weight338.70

Purity≥95.0 (HPLC)%

Density1.3946 (rough estimate)

Boiling Point454.94°C (rough estimate)

Melting Point>350ºC

Flash Point

Appearance

EINECS208-437-0

MSDSChineseEnglish

Symboltransportation

Signal WordWarning

Cat. No.: 2A-9051183 Purity: ≥95.0 (HPLC)%
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Chemical & Physical Properties
CAS Number528-53-0
Catalog No.2A-9051183
Chinese Name氯化飞燕草素
SynonymsT66 BOJ CR CQ DQ DQ& GQ IQ &&Chloride; 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol,chloride; 3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium chloride; Delphinidin chloride; 3,3',4',5,5',7-hexahydroxy-2-phenylbenzopyrylium chloride; 1-Benzopyrylium, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-, chloride (1:1)
Molecular FormulaC15H11ClO7
Molecular Weight338.70
Purity≥95.0 (HPLC)
Density1.3946 (rough estimate)
Boiling Point454.94°C (rough estimate)
Melting Point>350ºC
Storage Condition−20°C
ApplicationDelphinidin chloride is an anthocyanin isolated from berries and red wine. Delphinidin chloride exhibits endothelium-dependent vasodilation. Delphinidin chloride can also regulate JAK/STAT3 and MAPKIS
EINECS208-437-0
HTC2907299090
PubChem ID57650189
MDL NumberMFCD00016663
SMILES[Cl-].Oc1cc(O)c2cc(O)c([o+]c2c1)-c3cc(O)c(O)c(O)c3
InChI1S/C15H10O7.ClH/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6;/h1-5H,(H5-,16,17,18,19,20,21);1H
InChI KeyFFNDMZIBVDSQFI-UHFFFAOYSA-N
NACRES CodeNA.24
UNSPSC41116107
Hazard Symbolstransportation
MSDSmsds/51183_1_528_53_0.pdf
BioactivityDelphinidin chloride, an anthocyanidin, is isolated from berries and red wine. Delphinidin chloride shows endothelium-dependent vasorelaxation. Delphinidin chloride also can modulate JAK/STAT3 and MAPKinase signaling to induce apoptosis in HCT116 cells[1][2][3]. Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Signaling Pathways >> Stem Cell/Wnt >> STAT Research Areas >> Cancer Research Areas >> Cardiovascular Disease Signaling Pathways >> JAK/STAT Signaling >> JAK Signaling Pathways >> Epigenetics >> JAK Signaling Pathways >> Stem Cell/Wnt >> JAK Signaling Pathways >> JAK/STAT Signaling >> STAT References [1]. Nyman NA, et, al. Determination of anthocyanidins in berries and red wine by high-performance liquid chromatography. J Agric Food Chem. 2001 Sep;49(9):4183-7. [2]. Andriambeloson E, et, al. Natural dietary polyphenolic compounds cause endothelium-dependent vasorelaxation in rat thoracic aorta. J Nutr. 1998 Dec;128(12):2324-33. [3]. Zhang Z, et, al. Delphinidin modulates JAK/STAT3 and MAPKinase signaling to induce apoptosis in HCT116 cells. Environ Toxicol. 2021 May 6. Chemical & Physical Properties Density 1.3946 (rough estimate) Boiling Point 454.94°C (rough estimate) Melting Point >350ºC Molecular Formula C15H11ClO7 Molecular Weight 338.697 Exact Mass 338.019318 PSA 134.52000 Index of Refraction 1.4429 (estimate) InChIKey FFNDMZIBVDSQFI-UHFFFAOYSA-N SMILES Oc1cc(O)c2cc(O)c(-c3cc(O)c(O)c(O)c3)[o+]c2c1.[Cl-] Storage condition −20°C
Use ofProperties Articles32 Name delphinidin chloride Synonym More Synonyms Delphinidin chloride Biological Activity Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Signaling Pathways >> Stem Cell/Wnt >> STAT Research Areas >> Cancer Research Areas >> Cardiovascular Disease Signaling Pathways >> JAK/STAT Signaling >> JAK Signaling Pathways >> Epigenetics >> JAK Signaling Pathways >> Stem Cell/Wnt >> JAK Signaling Pathways >> JAK/STAT Signaling >> STAT References [1]. Nyman NA, et, al. Determination of anthocyanidins in berries and red wine by high-performance liquid chromatography. J Agric Food Chem. 2001 Sep;49(9):4183-7. [2]. Andriambeloson E, et, al. Natural dietary polyphenolic compounds cause endothelium-dependent vasorelaxation in rat thoracic aorta. J Nutr. 1998 Dec;128(12):2324-33. Chemical & Physical Properties Exact Mass 338.019318 PSA 134.52000 Index of Refraction 1.4429 (estimate) InChIKey FFNDMZIBVDSQFI-UHFFFAOYSA-N
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Transport InfoProduct name: Purity: 98.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special precautions for users No data available
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