ChemicalBook--->CAS DataBase List--->108605-70-5

108605-70-5

108605-70-5 Structure

108605-70-5 Structure
IdentificationBack Directory
[Name]

AVENANTHRAMIDEA
[CAS]

108605-70-5
[Synonyms]

AVENANTHRAMIDEA
Avenanthramide Bp
N-(4′-Hydroxy-(E)-cinnamoyl)-5-hydroxyanthranilic acid
5-Hydroxy-2-{[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]amino}benzoic acid
5-Hydroxy-2-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]benzoic acid
Benzoic acid, 5-hydroxy-2-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]-
[Molecular Formula]

C16H13NO5
[MDL Number]

MFCD23380830
[MOL File]

108605-70-5.mol
[Molecular Weight]

299.28
Chemical PropertiesBack Directory
[Melting point ]

258-260°C
[Boiling point ]

644.7±55.0 °C(Predicted)
[density ]

1.490±0.06 g/cm3(Predicted)
[storage temp. ]

Amber Vial, -20°C Freezer
[solubility ]

Methanol (Slightly, Heated)
[form ]

Solid
[pka]

3.39±0.36(Predicted)
[color ]

Very Dark Yellow
[Stability:]

Light Sensitive
[Cosmetics Ingredients Functions]

SKIN PROTECTING
ANTIOXIDANT
HAIR CONDITIONING
[InChI]

1S/C16H13NO5/c18-11-4-1-10(2-5-11)3-8-15(20)17-14-7-6-12(19)9-13(14)16(21)22/h1-9,18-19H,(H,17,20)(H,21,22)/b8-3+
[InChIKey]

QGUMNWHANDITDB-FPYGCLRLSA-N
[SMILES]

OC1=CC=C(NC(/C=C/C2=CC=C(O)C=C2)=O)C(C(O)=O)=C1
[LogP]

2.910 (est)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

Avenanthramide A performs a mild inhibitory activity on thrombin, trypsin, plasmin and papain. Avenanthramideis also an anti-inflammatory, antioxidant, anti-itch, anti-irritant and antiatherogenic agent.
[Definition]

ChEBI: Avenanthramide A is a hydroxycinnamic acid. It is a conjugate acid of an avenanthramide A(1-).
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