FL2FBANC0004

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Upper classes : FL Flavonoid : FL2 Flavanone :  FL2FBA Naringenin 5-methyl ether (17 pages) :  FL2FBANC Flavonoid substituted by complex substituent (11 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	332877-81-3
KEGG	{{{KEGG}}}
KNApSAcK	C00014288
CDX file
MOL file	FL2FBANC0004.mol

Calyxin J
Structural Information
Systematic Name	(8R) -2,3,8abeta,9,12,12aalpha-Hexahydro-2,8beta,9beta-tris (4-hydroxyphenyl) -11beta- (4-hydroxyphenethyl) -5-methoxy-4H,8H,11H-1,7,10-trioxabenzo [ c ] phenanthrene-4-one
Common Name	Calyxin J (8R) -2,3,8abeta,9,12,12aalpha-Hexahydro-2,8beta,9beta-tris (4-hydroxyphenyl) -11beta- (4-hydroxyphenethyl) -5-methoxy-4H,8H,11H-1,7,10-trioxabenzo [ c ] phenanthrene-4-one
Symbol
Formula	C42H38O9
Exact Mass	686.251582814
Average Mass	686.74572
SMILES	c(c71)(C(=O)CC(c(c8)ccc(c8)O)O7)c(cc(O5)c1C(C(C5c(c6)ccc(O)c6)2)CC(CCc(c4)ccc(c4)O)OC2c(c3)ccc(O)c3)OC
Physicochemical Information
Melting Point
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Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Alpinia blepharocalyx FL2FBANC0004 See above. Kadota_S et al. 2003