KEGG   COMPOUND: C09727Help
Entry
C09727                      Compound                               

Name
(-)-Epicatechin
Formula
C15H14O6
Exact mass
290.079
Mol weight
290.2681
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00941  Flavonoid biosynthesis
map01061  Biosynthesis of phenylpropanoids
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C09727  (-)-Epicatechin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavan 3-ols
    C09727  (-)-Epicatechin
BRITE hierarchy
Other DBs
CAS: 490-46-0
PubChem: 11915
ChEBI: 90
ChEMBL: CHEMBL583912 CHEMBL80941
LIPIDMAPS: LMPK12020003
KNApSAcK: C00000956
PDB-CCD: 28E[PDBj]
3DMET: B03226
NIKKAJI: J21.603H
KCF data Show

ATOM        21
            1   C1y C    21.6380  -14.8589
            2   O2x O    20.4317  -14.1537
            3   C1y C    21.6321  -16.2633
            4   C8y C    19.2137  -14.8530
            5   C1x C    20.4200  -16.9510
            6   O1a O    22.8443  -16.9627
            7   C8y C    19.2079  -16.2517
            8   C8x C    18.0016  -14.1479
            9   C8y C    18.0016  -16.9510
            10  C8y C    16.7893  -14.8530
            11  C8x C    16.7893  -16.2517
            12  O1a O    18.0073  -18.3497
            13  O1a O    15.5713  -14.1479
            14  C8y C    22.8560  -14.1596
            15  C8x C    22.8560  -12.7609
            16  C8x C    24.0624  -14.8763
            17  C8x C    24.0740  -12.0732
            18  C8y C    25.2804  -14.1770
            19  C8y C    25.2861  -12.7726
            20  O1a O    26.4925  -12.0790
            21  O1a O    26.4857  -14.8780
BOND        23
            1     7   9 1
            2     8  10 2
            3     9  11 2
            4     9  12 1
            5    10  13 1
            6     5   7 1
            7    10  11 1
            8     1  14 1 #Down
            9     1   2 1
            10    1   3 1
            11    2   4 1
            12    3   5 1
            13    3   6 1 #Down
            14    4   7 2
            15    4   8 1
            16   14  15 1
            17   14  16 2
            18   15  17 2
            19   16  18 1
            20   17  19 1
            21   19  20 1
            22   18  19 2
            23   18  21 1

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