agrimoniin

Modify Date: 2025-08-25 17:31:57

agrimoniin structure	Common Name	agrimoniin
	CAS Number	82203-01-8	Molecular Weight	1871.27000
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₈₂H₅₄O₅₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Use of agrimoniin

Agrimoniin is a phenolic compound isolated in the fruit of Fragaria vesca[1].

Name	agrimoniin

Description	Agrimoniin is a phenolic compound isolated in the fruit of Fragaria vesca[1].
Related Catalog	Research Areas >> Others Signaling Pathways >> Others >> Others
References	[1]. Vrhovsek U, et al. Clarifying the identity of the main ellagitannin in the fruit of the strawberry, Fragaria vesca and Fragaria ananassa Duch. J Agric Food Chem. 2012 Mar 14;60(10):2507-16.

Molecular Formula	C₈₂H₅₄O₅₂
Molecular Weight	1871.27000
Exact Mass	1870.16000
PSA	877.36000
LogP	3.69390
InChIKey	BZAFROBDXRJYTQ-JVEQELPQSA-N
SMILES	O=C(OC1OC2COC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC2C2OC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC12)c1cc(O)c(O)c(Oc2c(C(=O)OC3OC4COC(=O)c5cc(O)c(O)c(O)c5-c5c(cc(O)c(O)c5O)C(=O)OC4C4OC(=O)c5cc(O)c(O)c(O)c5-c5c(cc(O)c(O)c5O)C(=O)OC34)cc(O)c(O)c2O)c1

Hazard Codes	Xi

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China
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China
Product Name: Agrimoniin
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