FL1CQUCCN001

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Upper classes : FL Flavonoid : FL1 Aurone and Chalcone : FL1C Chalcone :  FL1CQU Quinochalcone (14 pages) :  FL1CQUCC Flavonoid C-glycoside substituted by complex substituent (0 pages) :  FL1CQUCCN Nitrogen incluted (0 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	149475-43-4
KEGG	{{{KEGG}}}
KNApSAcK	C00014590
CDX file
MOL file	FL1CQUCCN001.mol

Tinctormine
Structural Information
Systematic Name	3,4-Dihydroxy-2- [ (E) -3- (4-hydroxyphenyl) acryloyl ] -4- (beta-D-glucopyranosyl) -5- [ hydroxy [ 3beta,4alpha-dihydroxy-5beta- (hydroxymethyl) pyrrolidin-2-ylidene ] methyl ] -2,5-cyclohexadien-1-one
Common Name	Tinctormine 3,4-Dihydroxy-2- [ (E) -3- (4-hydroxyphenyl) acryloyl ] -4- (beta-D-glucopyranosyl) -5- [ hydroxy [ 3beta,4alpha-dihydroxy-5beta- (hydroxymethyl) pyrrolidin-2-ylidene ] methyl ] -2,5-cyclohexadien-1-one
Symbol
Formula	C27H31NO14
Exact Mass	593.174454705
Average Mass	593.5333800000001
SMILES	C(C1O)(C(C(O)=3)(C(=CC(C3C(=O)C=Cc(c4)ccc(O)c4)=O)C(=C(N2)C(C(O)C2CO)O)O)O)OC(C(C1O)O)CO
Physicochemical Information
Melting Point
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Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
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UV Spectra
IR Spectra
NMR Spectra
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Species Information

Species-Flavonoid Relationship Reported
Species ID Metabolite Name Reference Carthamus tinctorius FL1CQUCCN001 See above. Meselhy_MR et al. 1993 Carthamus tinctorius FL1CQUCCN001 See above. Meselhy_MR et al. 1992