Patuletin

ScientificNameLabel

Patuletin
PHCD compound ID :	5185
Chemical Names :	Patuletin
Molecular Formula :	C16H12O8
Molecular Weight :	332.053217

More Details :

Names & Synonyms:	2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-chromen-4-one , 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-1-benzopyran-4-one , 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxychromen-4-one , 2-[3,4-bis(oxidanyl)phenyl]-6-methoxy-3,5,7-tris(oxidanyl)chromen-4-one , 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-methoxy-chromone
Smiles:	COc1c(O)cc2c(c1O)c(=O)c(c(o2)c1ccc(c(c1)O)O)O
InChi :	InChI=1S/C16H12O8/c1-23-16-9(19)5-10-11(13(16)21)12(20)14(22)15(24-10)6-2-3-7(17)8(18)4-6/h2-5,17-19,21-22H,1H3
InChi Key :	InChIKey=JMIFIYIEXODVTO-UHFFFAOYSA-N
PubChem ID :	5281678

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	8	Ionization potential :	9.138305
Hydrogen bond donor count :	5	Electric dipole moment :	1.043
XLogP :	2.074	VDW volume :	275.652981
Molecular weight :	332.053217	HOMO-LUMO gap :	8.116000

Herb list :

Celandine, Swallowwort - Chelidonium majus L - مامیران

Refrences & Litretures:


820. Journal:'Not Bot Horti Agrobo' Year:'2013' Volume:'41' Page:'414' DOI:'' Title:'Chemical Composition of Celandine (Chelidonium majus L.) Extract and its Efects on Botrytis tulipae (Lib.) Lind Fungus and the Tulip'

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