artemidinol

ScientificNameLabel

artemidinol
PHCD compound ID :	2015
Chemical Names :	artemidinol
Molecular Formula :	C13H12O3
Molecular Weight :	216.078644

More Details :

Names & Synonyms:	3-[(E)-but-1-enyl]-5-hydroxy-isochromen-1-one , 3-[(E)-but-1-enyl]-5-hydroxy-2-benzopyran-1-one , 3-[(E)-but-1-enyl]-5-hydroxyisochromen-1-one , 3-[(E)-but-1-enyl]-5-oxidanyl-isochromen-1-one , 3-[(E)-but-1-enyl]-5-hydroxy-isocoumarin
Smiles:	CC/C=C/c1oc(=O)c2c(c1)c(O)ccc2
InChi :	InChI=1S/C13H12O3/c1-2-3-5-9-8-11-10(13(15)16-9)6-4-7-12(11)14/h3-8,14H,2H2,1H3/b5-3+
InChi Key :	InChIKey=QBZHMYUXUVZDQT-HWKANZROSA-N
PubChem ID :	23264915

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	8.596991
Hydrogen bond donor count :	1	Electric dipole moment :	3.337
XLogP :	2.151	VDW volume :	208.343269
Molecular weight :	216.078644	HOMO-LUMO gap :	7.644000

Herb list :

Tarragon, Wild dragon - Artemisia dracunculus - ترخون

Refrences & Litretures:


239. Journal:'J. Agric. Food Chem' Year:'2011' Volume:'59' Page:'11367' DOI:'10.1021/jf202277w' Title:'Artemisia dracunculus L. (Tarragon): A Critical Review of Its Traditional Use, Chemical Composition, Pharmacology, and Safety'

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