COMPOUND: C12627


Entry
C12627                      Compound                               
Name
Apigenin 7-O-neohesperidoside;
Rhoifolin;
Rhoifoloside
Formula
C27H30O14
Exact mass
578.1636
Mol weight
578.5187
Structure
Reaction
R06826
Pathway
map00944  Flavone and flavonol biosynthesis
Enzyme
2.4.1.236
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C12627  Apigenin 7-O-neohesperidoside
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavones
    C12627  Apigenin 7-O-neohesperidoside
Glycosides [BR:br08021]
 O-glycosides
  Flavonoid glycosides
   Flavones and flavonols
    C12627  Apigenin 7-O-neohesperidoside
Other DBs
CAS: 17306-46-6
PubChem: 583017
ChEBI: 31227
LIPIDMAPS: LMPK12110356
KNApSAcK: C00004157
NIKKAJI: J13.923H
KCF data

ATOM        41
            1   C8y C    28.9540  -25.4846
            2   C8y C    28.9482  -26.8689
            3   O2x O    30.1572  -24.8013
            4   C8x C    27.7743  -24.7954
            5   C8y C    30.1455  -27.5581
            6   C8y C    27.7743  -27.5522
            7   C8y C    31.3429  -25.4905
            8   C8y C    26.5710  -25.4846
            9   C8x C    31.3369  -26.8747
            10  O5x O    30.1396  -28.9305
            11  C8x C    26.5710  -26.8689
            12  O1a O    27.7743  -28.9248
            13  O2a O    25.3796  -24.7896
            14  C1y C    23.9370  -25.5139
            15  C1y C    23.9370  -26.8863
            16  O2x O    22.7514  -24.8247
            17  O2a O    25.1051  -27.8559
            18  C1y C    22.7514  -27.5815
            19  C1y C    21.5541  -25.5139
            20  C1y C    25.1051  -29.9234
            21  C1y C    21.5541  -26.8863
            22  O1a O    22.7572  -28.9539
            23  C1b C    20.3685  -24.8247
            24  C1y C    26.2966  -30.6069
            25  O2x O    23.9137  -30.6069
            26  O1a O    20.3685  -27.5815
            27  O1a O    19.1711  -25.5080
            28  C1y C    26.2966  -31.9910
            29  O1a O    27.4880  -29.9234
            30  C1y C    23.9137  -31.9910
            31  C1y C    25.1051  -32.6744
            32  O1a O    27.4880  -32.6744
            33  C1a C    22.7221  -32.6744
            34  O1a O    25.1051  -34.0528
            35  C8y C    32.5402  -24.8130
            36  C8x C    33.7199  -25.5080
            37  C8x C    32.5402  -23.4405
            38  C8x C    34.9172  -24.8247
            39  C8x C    33.7375  -22.7571
            40  C8y C    34.9232  -23.4521
            41  O1a O    36.1205  -22.7630
BOND        45
            1     4   8 2
            2     5   9 1
            3     5  10 2
            4     6  11 2
            5     6  12 1
            6     8  13 1
            7    14  13 1 #Up
            8    14  15 1
            9    14  16 1
            10   15  17 1 #Down
            11   15  18 1
            12   16  19 1
            13   20  17 1 #Up
            14   18  21 1
            15   18  22 1 #Up
            16   19  23 1 #Up
            17   20  24 1
            18   20  25 1
            19   21  26 1 #Down
            20   23  27 1
            21   24  28 1
            22   24  29 1 #Down
            23   25  30 1
            24   28  31 1
            25   28  32 1 #Down
            26   30  33 1 #Down
            27   31  34 1 #Up
            28    7   9 2
            29    8  11 1
            30   19  21 1
            31   30  31 1
            32    7  35 1
            33    1   2 2
            34    1   3 1
            35    1   4 1
            36    2   5 1
            37    2   6 1
            38    3   7 1
            39   35  36 2
            40   35  37 1
            41   36  38 1
            42   37  39 2
            43   38  40 2
            44   40  41 1
            45   39  40 1

» Japanese version

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Pathway (1)   
   KEGG PATHWAY (1)   
Chemical substance (14)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   KNApSAcK (1)   
   LIPIDMAPS (1)   
   MASSBANK (8)   
   NIKKAJI (1)   
Chemical reaction (2)   
   KEGG ENZYME (1)   
   KEGG REACTION (1)   
Gene (11)   
   KEGG GENES (11)   
All databases (28)   

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