Pimpinellin

ScientificNameLabel

Pimpinellin
PHCD compound ID :	5328
Chemical Names :	Pimpinellin
Molecular Formula :	C13H10O5
Molecular Weight :	246.052823

More Details :

Names & Synonyms:	5,6-dimethoxyfuro[2,3-h]chromen-2-one , 5,6-dimethoxy-2-furo[2,3-h][1]benzopyranone
Smiles:	COc1c(OC)c2occc2c2c1ccc(=O)o2
InChi :	InChI=1S/C13H10O5/c1-15-11-7-3-4-9(14)18-10(7)8-5-6-17-12(8)13(11)16-2/h3-6H,1-2H3
InChi Key :	InChIKey=BQPRWZCEKZLBHL-UHFFFAOYSA-N
PubChem ID :	4825

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	5	Ionization potential :	8.782430
Hydrogen bond donor count :	0	Electric dipole moment :	5.622
XLogP :	1.577	VDW volume :	202.667264
Molecular weight :	246.052823	HOMO-LUMO gap :	7.832000

Herb list :

Forest pepper - Toddalia asiatica Lam - دهن باز دهن بسته

Refrences & Litretures:


867. Journal:'Parasitol Res' Year:'2013' Volume:'112' Page:'1197' DOI:'10.1007/s00436-012-3251-9' Title:'Essential oil composition and larvicidal activity of Toddalia asiatica roots against the mosquito Aedes albopictus (Diptera: Culicidae)'

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