avenanthramide A

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IUPAC Name :5-hydroxy-2-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]benzoic acid
InChI :InChI=1/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+
Std.InChI: 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-FPYGCLRLBQ
Std.InChIKey: QGUMNWHANDITDB-FPYGCLRLSA-N
SMILES :C1=CC(=CC=C1/C=C/C(=O)NC2=C(C=C(C=C2)O)C(=O)O)O
MDL: MFCD23380830
Molar Refractivity :78.49 ± 0.5 cm3 (est)
Parachor :610.6 ± 8.0 cm3 (est)
Index of Refraction :1.617 ± 0.05 (est)
Surface Tension :54.9 ± 7.0 dyne/cm (est)
Density :1.33 ± 0.1 g/cm3 (est)
Polarizability :31.11 ± 0.5 10-24cm3 (est)