COMPOUND: C12095


Entry
C12095                      Compound                               
Name
Cyanidin 3-O-(6-O-p-coumaroyl)glucoside
Formula
C30H27O13
Exact mass
595.1452
Mol weight
595.5276
Structure
Reaction
R06544 R06547
Pathway
map00942  Anthocyanin biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
2.3.1.215       2.4.1.298
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1201 Anthocyanidins
    C12095  Cyanidin 3-O-(6-O-p-coumaroyl)glucoside
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Anthocyanidins and anthocyanins
    C12095  Cyanidin 3-O-(6-O-p-coumaroyl)glucoside
Glycosides [BR:br08021]
 O-glycosides
  Anthocyanin glycosides
   Glycosylated cyanidin
    C12095  Cyanidin 3-O-(6-O-p-coumaroyl)glucoside
Other DBs
PubChem: 14243
ChEBI: 29560
LIPIDMAPS: LMPK12010139
KNApSAcK: C00006800
3DMET: B04418
NIKKAJI: J657.837C
KCF data

ATOM        43
            1   C1b C    29.4533  -34.7841
            2   O7a O    28.2442  -35.4851
            3   C7a C    28.2309  -36.8783
            4   C2b C    27.0141  -37.5655
            5   O6a O    29.4344  -37.5886
            6   C2b C    27.0028  -38.9605
            7   C8y C    25.7871  -39.6494
            8   C8x C    24.5895  -38.9386
            9   C8x C    23.3736  -39.6275
            10  C8y C    23.3624  -41.0250
            11  C8x C    24.5669  -41.7334
            12  C8x C    25.7828  -41.0445
            13  O1a O    22.1465  -41.7139
            14  C8y C    25.8260  -28.4816
            15  C8y C    25.8201  -29.8835
            16  C8y C    27.0468  -27.7807
            17  O2x O    24.6169  -27.7690 #+
            18  O2a O    26.9240  -30.5201
            19  C8x C    24.6052  -30.5785
            20  C8x C    28.2617  -28.4874
            21  C8x C    27.0468  -26.3730
            22  C8y C    23.3961  -28.4699
            23  C1y C    28.2383  -31.2911
            24  C8y C    23.3902  -29.8718
            25  C8y C    29.4825  -27.7864
            26  C8x C    28.2676  -25.6721
            27  C8x C    22.1811  -27.7632
            28  O2x O    28.2383  -32.6871
            29  C1y C    29.4533  -30.5902
            30  C8y C    22.1811  -30.5727
            31  C8y C    29.4882  -26.3788
            32  O1a O    30.6916  -28.4874
            33  C8y C    20.9662  -28.4699
            34  C1y C    29.4533  -33.3880
            35  C1y C    30.6565  -31.2911
            36  O1a O    29.4533  -29.4042
            37  C8x C    20.9662  -29.8718
            38  O1a O    30.6974  -25.6838
            39  O1a O    19.7571  -27.7749
            40  C1y C    30.6565  -32.6871
            41  O1a O    31.8714  -30.5902
            42  O1a O    31.8714  -33.3823
            43  O1a O    22.1824  -31.9702
BOND        47
            1     2   3 1
            2     3   4 1
            3     3   5 2
            4     4   6 2
            5     7   8 2
            6     8   9 1
            7     9  10 2
            8    10  11 1
            9    11  12 2
            10   12   7 1
            11   10  13 1
            12    6   7 1
            13    1   2 1
            14   29  36 1 #Down
            15   30  37 2
            16   31  38 1
            17   33  39 1
            18   34  40 1
            19   34   1 1 #Up
            20   35  41 1 #Up
            21   40  42 1 #Down
            22   22  24 2
            23   26  31 1
            24   33  37 1
            25   35  40 1
            26   14  15 1
            27   14  16 1
            28   14  17 2
            29   15  18 1
            30   15  19 2
            31   16  20 2
            32   16  21 1
            33   17  22 1
            34   23  18 1 #Up
            35   19  24 1
            36   30  43 1
            37   20  25 1
            38   21  26 2
            39   22  27 1
            40   23  28 1
            41   23  29 1
            42   24  30 1
            43   25  31 2
            44   25  32 1
            45   27  33 2
            46   28  34 1
            47   29  35 1

» Japanese version

  All links  
Pathway (2)   
   KEGG PATHWAY (2)   
Chemical substance (7)   
   PubChem (1)   
   ChEBI (1)   
   3DMET (1)   
   HMDB (1)   
   KNApSAcK (1)   
   LIPIDMAPS (1)   
   NIKKAJI (1)   
Chemical reaction (4)   
   KEGG ENZYME (2)   
   KEGG REACTION (2)   
Gene (16)   
   KEGG GENES (16)   
All databases (29)   

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