KEGG   COMPOUND: C09210
Entry
C09210                      Compound                               
Name
(-)-Columbianetin;
(R)-Columbianetin
Formula
C14H14O4
Exact mass
246.0892
Mol weight
246.2586
Structure
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Coumarins
   Furanocoumarins
    C09210  (R)-Columbianetin
Other DBs
CAS: 52842-47-4
PubChem: 11401
ChEBI: 3828
KNApSAcK: C00002459
3DMET: B02770
NIKKAJI: J89.726D
KCF data

ATOM        18
            1   C8x C    26.2489  -13.8000
            2   C8x C    27.4610  -13.1019
            3   C8y C    28.6660  -13.8000
            4   C8y C    28.7299  -15.1963
            5   O7x O    29.8661  -15.8995
            6   C8y C    31.0784  -15.2066
            7   C8x C    31.0843  -13.8103
            8   C8x C    29.8781  -13.1071
            9   O6a O    32.2846  -15.9098
            10  C8y C    27.4610  -15.8944
            11  C8y C    26.2484  -15.1912
            12  O2x O    25.2050  -16.1271
            13  C1y C    25.7728  -17.4086
            14  C1x C    27.1669  -17.2647
            15  C1d C    25.7591  -18.7370
            16  C1a C    24.5429  -19.4228
            17  C1a C    26.9612  -19.4473
            18  O1a O    25.7611  -20.2305
BOND        20
            1     1  11 1
            2     6   9 2
            3    10   4 1
            4     3   2 1
            5     2   1 2
            6     3   4 2
            7    10  11 2
            8    11  12 1
            9    12  13 1
            10   13  14 1
            11   14  10 1
            12    4   5 1
            13    5   6 1
            14   13  15 1
            15    6   7 1
            16   15  16 1
            17    7   8 2
            18   15  17 1
            19    8   3 1
            20   15  18 1

» Japanese version

  All links  
Chemical substance (5)   
   PubChem (1)   
   ChEBI (1)   
   3DMET (1)   
   KNApSAcK (1)   
   NIKKAJI (1)   
All databases (5)   

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