E,Z-3-(3,5-dimethoxy-4-hydroxybenzylidène)-2-indolinone

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E,Z-3-(3,5-dimethoxy-4-hydroxybenzylidène)-2-indolinone
PHCD compound ID :	4746
Chemical Names :	E,Z-3-(3,5-dimethoxy-4-hydroxybenzylidène)-2-indolinone
Molecular Formula :	C17H15N1O4
Molecular Weight :	297.100108

More Details :

Names & Synonyms:	(3E)-3-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]indolin-2-one , (3E)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1H-indol-2-one , (3E)-3-[(3,5-dimethoxy-4-oxidanyl-phenyl)methylidene]-1H-indol-2-one , (3E)-3-(4-hydroxy-3,5-dimethoxy-benzylidene)oxindole
Smiles:	COc1cc(/C=C\2/C(=O)Nc3c2cccc3)cc(c1O)OC
InChi :	InChI=1S/C17H15NO4/c1-21-14-8-10(9-15(22-2)16(14)19)7-12-11-5-3-4-6-13(11)18-17(12)20/h3-9,19H,1-2H3,(H,18,20)/b12-7+
InChi Key :	InChIKey=YSERLISPSDGHNH-KPKJPENVSA-N
PubChem ID :	2437104

Rotatable bond count :	3	Rule of five :	0
Hydrogen bond acceptor count :	5	Ionization potential :	8.758306
Hydrogen bond donor count :	2	Electric dipole moment :	4.512
XLogP :	1.46	VDW volume :	268.784819
Molecular weight :	297.100108	HOMO-LUMO gap :	7.834000

Herb list :

Woad - Isatis tinctoria - وسمه

Refrences & Litretures:


751. Journal:'Phytothérapie' Year:'2012' Volume:'10' Page:'238' DOI:'10.1007/s10298-012-0717-y' Title:'Isatis tinctoria L. Brassicaceae : le pastel des teinturiers'

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