FL63ACNS0020

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Upper classes : FL Flavonoid : FL6 Flavan : FL63 Flavan 3-ol :  FL63AC Catechin and Epicatechin (75 pages) :  FL63ACNS Simple substitution (24 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	110784-26-4
KEGG	{{{KEGG}}}
KNApSAcK	C00008880
CDX file
MOL file	FL63ACNS0020.mol

Catechin 7,3'-di-O-gallate
Structural Information
Systematic Name	(2R,3S) -3,5,7,3',4'-Pentahydroxyflavan 7,3'-di-O-gallate
Common Name	Catechin 7,3'-di-O-gallate (2R,3S) -3,5,7,3',4'-Pentahydroxyflavan 7,3'-di-O-gallate
Symbol
Formula	C29H22O14
Exact Mass	594.100955412
Average Mass	594.47658
SMILES	O(c(c5)cc(c4c(O)5)OC(C(C4)O)c(c2)ccc(c2OC(c(c3)cc(O)c(c(O)3)O)=O)O)C(c(c1)cc(c(O)c1O)O)=O
Physicochemical Information
Melting Point
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Optical Rotation
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Spectral Information
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Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Acacia gerrardii FL63ACNS0020 See above. Malan_E et al. 1987