KEGG   COMPOUND: C10788Help
Entry
C10788                      Compound                               

Name
Ellagic acid
Formula
C14H6O8
Exact mass
302.0063
Mol weight
302.1926
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Phytochemical compounds [BR:br08003]
 Others
  Tannins and galloyl derivatives
   Galloyl derivatives
    C10788  Ellagic acid
Target-based classification of compounds [BR:br08010]
 Enzymes
  Oxidoreductases
   tyrosinase
    C10788  Ellagic acid
BRITE hierarchy
Other DBs
CAS: 
476-66-4
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   C8x C    23.5203  -18.2140
            2   C8y C    23.5203  -19.6159
            3   C8y C    24.7383  -20.3204
            4   C8y C    25.9432  -19.6159
            5   O7x O    27.1482  -20.3255
            6   C8y C    28.3663  -19.6262
            7   C8y C    24.7383  -17.5166
            8   C8y C    25.9463  -18.2191
            9   O7x O    25.9623  -15.4225
            10  C8y C    24.6763  -16.1181
            11  C8y C    27.1552  -17.5304
            12  C8y C    28.3665  -18.2272
            13  C8x C    29.5791  -17.5328
            14  C8y C    29.5805  -16.1343
            15  C8y C    28.3692  -15.4304
            16  C8y C    27.1565  -16.1320
            17  O6a O    23.5353  -15.4068
            18  O6a O    29.5800  -20.3333
            19  O1a O    24.7416  -21.7224
            20  O1a O    22.3056  -20.3211
            21  O1a O    28.3705  -14.0284
            22  O1a O    30.7962  -15.4309
BOND        25
            1     9  10 1
            2    10   7 1
            3     2   3 1
            4     8   4 1
            5     4   5 1
            6     5   6 1
            7     6  12 1
            8     3   4 2
            9    11  12 1
            10   12  13 2
            11   13  14 1
            12   14  15 2
            13   15  16 1
            14   16  11 2
            15    7   1 1
            16   10  17 2
            17    6  18 2
            18    1   2 2
            19    3  19 1
            20    7   8 2
            21    2  20 1
            22    8  11 1
            23   15  21 1
            24   16   9 1
            25   14  22 1

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