Glabrene

ScientificNameLabel

Glabrene
PHCD compound ID :	3672
Chemical Names :	Glabrene
Molecular Formula :	C20H18O4
Molecular Weight :	322.120509

More Details :

Names & Synonyms:	8-(7-hydroxy-2H-chromen-3-yl)-2,2-dimethyl-chromen-5-ol , 8-(7-hydroxy-2H-1-benzopyran-3-yl)-2,2-dimethyl-1-benzopyran-5-ol , 8-(7-hydroxy-2H-chromen-3-yl)-2,2-dimethylchromen-5-ol , 2,2-dimethyl-8-(7-oxidanyl-2H-chromen-3-yl)chromen-5-ol
Smiles:	Oc1ccc2c(c1)OCC(=C2)c1ccc(c2c1OC(C)(C)C=C2)O
InChi :	InChI=1S/C20H18O4/c1-20(2)8-7-16-17(22)6-5-15(19(16)24-20)13-9-12-3-4-14(21)10-18(12)23-11-13/h3-10,21-22H,11H2,1-2H3
InChi Key :	InChIKey=NGGYSPUAKQMTNP-UHFFFAOYSA-N
PubChem ID :	480774

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	4	Ionization potential :	8.256793
Hydrogen bond donor count :	2	Electric dipole moment :	2.970
XLogP :	2.463	VDW volume :	297.319554
Molecular weight :	322.120509	HOMO-LUMO gap :	7.847000

Herb list :

Licorice, Liquorice - Glycyrrhiza glabra - شیرین بیان

Refrences & Litretures:


512. Journal:'Food Chemistry' Year:'1990' Volume:'38' Page:'119' DOI:'' Title:'Liquorice, Glycyrrhiza glabra L. - Composition, Uses and Analysis'

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