ECHINACOSIDE | CAS No. 82854-37-3

ECHINACOSIDE

Basic Information

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CAS Number

82854-37-3

Molecular Formula

C35H46O20

Molecular Weight

786.7 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Boiling Point

1062.7°C at 760 mmHg

Solubility

Methanol,Water,DMSO

SMILES

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CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)COC4C(C(C(C(O4)CO)O)O)O)OCCC5=CC(=C(C=C5)O)O)O)O)O)O

InChI

InChI=1S/C35H46O20/c1-14-24(42)26(44)29(47)35(51-14)55-32-30(48)34(49-9-8-16-3-6-18(38)20(40)11-16)53-22(13-50-33-28(46)27(45)25(43)21(12-36)52-33)31(32)54-23(41)7-4-15-2-5-17(37)19(39)10-15/h2-7,10-11,14,21-22,24-40,42-48H,8-9,12-13H2,1H3/b7-4+/t14-,21+,22+,24-,25+,26+,27-,28+,29+,30+,31+,32+,33+,34+,35-/m0/s1

InChIKey

FSBUXLDOLNLABB-ISAKITKMSA-N

LogP

-3.1916999999999947

Topological Polar Surface Area

324.44 Å²

Hydrogen Bond Donor/Acceptor

12 / 20

Complexity

1230

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Storage Conditions

2-8℃

Synonyms & References

English

Echinacoside, 98% (HPLC)
CAS-82854-37-3
[(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Echinacoside Ethanolate
Q475631
NCGC00091915-02
CHEBI:4745
MFCD00075695
737806-07-4
DSSTox_CID_13469
.BETA.-D-GLUCOPYRANOSIDE, 2-(3,4-DIHYDROXYPHENYL)ETHYL O-6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->3)-O-(.BETA.-D-GLUCOPYRANOSYL-(1->6))-, 4-(3-(3,4-DIHYDROXYPHENYL)-2-PROPENOATE)
Echinacoside,(S)
SCHEMBL525502
DTXSID0033469
DTXCID8013469
MEGxp0_001773
(2R,3R,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-5-hydroxy-2-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-4-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl 3-(3,4-dihydroxyphenyl)acrylate
AS-56376
I04O1DT48T
UNII-I04O1DT48T
CCG-270479
AC1NQZ1Q
CHEMBL510539
Echinacoside, primary pharmaceutical reference standard
HMS3885K04
NS00121415
NCGC00091915-01
Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), beta-D-
SureCN525502
82854-37-3
s3783

MDL Number

MFCD00075695

FAQ

What is Echinacoside (CAS: 82854-37-3)?

Echinacoside is a flavonoid glycoside derived from plants, notably Echinacea purpurea. Its chemical formula is C21H20O12, and it is characterized by its white crystalline powder appearance, solubility in water and ethanol, and antioxidant properties. It is commonly used in natural remedies and research for its potential health benefits.

What are the main uses of Echinacoside (CAS: 82854-37-3)?

Echinacoside is primarily used in pharmaceuticals as an anti-inflammatory and immunostimulant agent. It also finds applications in cosmetics for skin health and in dietary supplements due to its antioxidant properties. Research explores its potential in treating inflammatory conditions and enhancing immune response.

Is Echinacoside (CAS: 82854-37-3) safe?

Echinacoside is generally considered safe when used as directed, with low toxicity in typical applications. However, proper handling precautions, such as avoiding inhalation and using protective gloves, are recommended. Safety standards ensure its compliance with pharmacopoeial requirements for purity and quality.

How should Echinacoside (CAS: 82854-37-3) be stored?

Echinacoside should be stored in a cool, dry place (2-8°C), protected from light and moisture. Keep in airtight, light-resistant containers to maintain stability. Avoid exposure to high humidity and heat to prevent degradation of its chemical properties.