KEGG   COMPOUND: C09305Help
Entry
C09305                      Compound                               

Name
Psoralen;
Ficusin
Formula
C11H6O3
Exact mass
186.0317
Mol weight
186.1635
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Biosynthesis of phenylpropanoids
Biosynthesis of secondary metabolites
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Coumarins
   Furanocoumarins
    C09305  Psoralen
BRITE hierarchy
Other DBs
CAS: 
66-97-7
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        14
            1   C8y C    28.4200  -17.6400
            2   C8y C    28.4200  -16.2400
            3   C8x C    29.5400  -18.4100
            4   C8x C    27.1600  -18.3400
            5   C8x C    29.6100  -15.5400
            6   O7x O    27.1600  -15.5400
            7   C8y C    30.8000  -17.7100
            8   C8x C    25.9700  -17.6400
            9   C8y C    30.8000  -16.3100
            10  C8y C    25.9700  -16.2400
            11  C8x C    32.1300  -18.1300
            12  O2x O    32.1300  -15.8900
            13  O6a O    24.7800  -15.4700
            14  C8x C    32.9700  -17.0100
BOND        16
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 2
            8     5   9 2
            9     6  10 1
            10    7  11 1
            11    9  12 1
            12   10  13 2
            13   11  14 2
            14    7   9 1
            15    8  10 1
            16   12  14 1

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