FL1DA9NR0001

Revision as of 09:00, 25 July 2008

Rubranine

Structural Information
Systematic Name	(E) -3-Phenyl-1- [ (2R) -3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano [ 4,3,2-de ] -1-benzopyran-7-yl ] -2-propen-1-one
Common Name	Rubranine (E) -3-Phenyl-1- [ (2R) -3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano [ 4,3,2-de ] -1-benzopyran-7-yl ] -2-propen-1-one
Symbol
Formula	C25H26O4
Exact Mass	390.18310931999997
Average Mass	390.47153999999995
SMILES	`C(C)(C)(O2)C(C5)([H])C(c13)(CC(C)(C5)Oc(cc(O)c(C(=O)C=Cc(c4)cccc4)c23)1)[H]`
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Species-Flavonoid Relationship Reported

Species	ID	Metabolite Name	Reference
Aniba rosaeodora	FL1DA9NR0001	See above.	De_Alleluia_IB et al. 1978
Boesenbergia pandurata	FL1DA9NR0001	See above.	De_Alleluia_IB et al. 1978
Aniba rosaeodora	FL1DA9NR0001	See above.	Tuntiwachwuttikul_P et al. 1984
Boesenbergia pandurata	FL1DA9NR0001	See above.	Tuntiwachwuttikul_P et al. 1984

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 {{Metabolite
-|SysName=(E)-3-Phenyl-1-[(2R)-3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano[4,3,2-de]-1-benzopyran-7-yl]-2-propen-1-one
+|SysName= (E) -3-Phenyl-1- [ (2R) -3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano [ 4,3,2-de ] -1-benzopyran-7-yl ] -2-propen-1-one
-|Common Name=&&Rubranine&&(E)-3-Phenyl-1-[(2R)-3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano[4,3,2-de]-1-benzopyran-7-yl]-2-propen-1-one&&
+|Common Name=&&Rubranine&& (E) -3-Phenyl-1- [ (2R) -3,3abeta,4,5-tetrahydro-8-hydroxy-2,5,5-trimethyl-2alpha,4alpha-ethano-2H-pyrano [ 4,3,2-de ] -1-benzopyran-7-yl ] -2-propen-1-one&&
 |CAS=31759-29-2
 |KNApSAcK=C00007133
 }}