KEGG   COMPOUND: C08325Help
Entry
C08325                      Compound                               

Name
Amygdalin;
(R)-Amygdalin;
(R)-Amygdaloside;
(R)-Laenitrile
Formula
C20H27NO11
Exact mass
457.1584
Mol weight
457.4285
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Cyanoamino acid metabolism
Enzyme
3.2.1.21        3.2.1.117
Brite
Phytochemical compounds [BR:br08003]
 Amino acid related compounds
  Cyanogenic glucosides
   Cyanogenic glucosides derived from phenylalanine
    C08325  Amygdalin
Natural toxins [BR:br08009]
 Phytotoxins
  Glycosides
   Cyanogenic glycosides
    C08325  Amygdalin
Major components of natural products [BR:br08323]
 Crude drugs
  Apricot kernel water
   C08325  Amygdalin
  Apricot kernel
   C08325  Amygdalin
  Peach kernel
   C08325  Amygdalin
BRITE hierarchy
Other DBs
CAS: 
29883-15-6
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
KCF data Show

ATOM        32
            1   C1y C    20.9096  -15.4509
            2   O2x O    19.6886  -14.7498
            3   O2a O    22.1191  -14.7498
            4   C1y C    20.9096  -16.8532
            5   C1y C    18.4851  -15.4509
            6   C1c C    23.3226  -15.4509
            7   C1y C    19.6886  -17.5543
            8   O1a O    22.1191  -17.5543
            9   C1y C    18.4851  -16.8532
            10  C1b C    17.2697  -14.7498
            11  C8y C    24.4970  -14.7088
            12  O1a O    19.6886  -18.9566
            13  O1a O    17.2697  -17.5543
            14  O2a O    16.2005  -15.6612
            15  C8x C    24.5086  -13.3123
            16  C8x C    25.7358  -15.3516
            17  C1y C    14.9910  -16.3683
            18  C8x C    25.6189  -12.5588
            19  C8x C    26.9158  -14.6036
            20  O2x O    13.7640  -15.6671
            21  C1y C    14.9910  -17.7705
            22  C8x C    26.9274  -13.2130
            23  C1y C    12.5604  -16.3740
            24  C1y C    13.7640  -18.4717
            25  O1a O    16.1946  -18.4717
            26  C1y C    12.5604  -17.7705
            27  C1b C    11.3452  -15.6671
            28  O1a O    13.7640  -19.8737
            29  O1a O    11.3452  -18.4717
            30  O1a O    10.2759  -16.5785
            31  C3b C    23.3694  -16.8473
            32  N3a N    23.3519  -18.2438
BOND        34
            1     1   2 1
            2     1   3 1 #Up
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 1 #Down
            8     5   9 1
            9     5  10 1 #Up
            10    6  11 1
            11    7  12 1 #Up
            12    9  13 1 #Down
            13   10  14 1
            14   11  15 2
            15   11  16 1
            16   17  14 1 #Up
            17   15  18 1
            18   16  19 2
            19   17  20 1
            20   17  21 1
            21   18  22 2
            22   20  23 1
            23   21  24 1
            24   21  25 1 #Down
            25   23  26 1
            26   23  27 1 #Up
            27   24  28 1 #Up
            28   26  29 1 #Down
            29   27  30 1
            30    7   9 1
            31   19  22 1
            32   24  26 1
            33   31  32 3
            34    6  31 1 #Down

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