KEGG   COMPOUND: C12127Help
Entry
C12127                      Compound                               

Name
(+)-Gallocatechin;
Gallocatechol
Formula
C15H14O7
Exact mass
306.074
Mol weight
306.2675
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Flavonoid biosynthesis
Biosynthesis of secondary metabolites
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C12127  (+)-Gallocatechin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavan 3-ols
    C12127  (+)-Gallocatechin
BRITE hierarchy
Other DBs
CAS: 
970-73-0
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   C1y C    26.9946  -20.5311
            2   C8y C    28.2126  -19.8318
            3   O2x O    25.7826  -19.8202
            4   C1y C    26.9887  -21.9298
            5   C8x C    28.2126  -18.4332
            6   C8x C    29.4247  -20.5428
            7   C8y C    24.5646  -20.5195
            8   C1x C    25.7709  -22.6232
            9   O1a O    28.1950  -22.6348
            10  C8y C    29.4306  -17.7339
            11  C8y C    30.6426  -19.8435
            12  C8y C    24.5587  -21.9239
            13  C8x C    23.3583  -19.8144
            14  C8y C    30.6426  -18.4391
            15  O1a O    29.4306  -16.3412
            16  C8y C    23.3583  -22.6174
            17  C8y C    22.1461  -20.5195
            18  O1a O    31.8549  -17.7455
            19  C8x C    22.1461  -21.9239
            20  O1a O    23.3583  -24.0160
            21  O1a O    20.9340  -19.8261
            22  O1a O    31.8491  -20.5421
BOND        24
            1     1   2 1 #Down
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 1
            8     4   9 1 #Up
            9     5  10 2
            10    6  11 1
            11    7  12 1
            12    7  13 2
            13   10  14 1
            14   10  15 1
            15   12  16 2
            16   13  17 1
            17   14  18 1
            18   16  19 1
            19   16  20 1
            20   17  21 1
            21    8  12 1
            22   11  14 2
            23   17  19 2
            24   11  22 1

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