KEGG   COMPOUND: C10597Help
Entry
C10597                      Compound                               

Name
Harringtonine
Formula
C28H37NO9
Exact mass
531.2468
Mol weight
531.5947
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    C10597  Harringtonine
BRITE hierarchy
Other DBs
CAS: 26833-85-2
PubChem: 12780
ChEBI: 5626
ChEMBL: CHEMBL433257
KNApSAcK: C00002342
3DMET: B03988
NIKKAJI: J48.396F
LinkDB All DBs
KCF data Show

ATOM        38
            1   C7a C    26.2690  -21.8821
            2   O7a O    27.4804  -22.5814
            3   O6a O    25.0576  -22.5814
            4   C1b C    26.2690  -20.4833
            5   C1a C    28.6916  -21.8821
            6   C1z C    30.3732  -15.6659
            7   C1y C    29.0051  -15.9758
            8   N1y N    30.9754  -14.3974
            9   C2x C    31.0981  -16.8644
            10  C1x C    31.3962  -16.6306
            11  C8y C    27.9119  -15.1047
            12  C1y C    28.9524  -17.3790
            13  C1x C    30.3674  -13.1344
            14  C1x C    32.3726  -14.5727
            15  C2y C    30.1802  -17.9285
            16  C1x C    32.6298  -15.9582
            17  C8y C    27.9119  -13.7132
            18  C8x C    26.7074  -15.8120
            19  O7a O    27.6662  -18.0688
            20  C1x C    29.0051  -12.8364
            21  O2a O    30.1745  -19.3140
            22  C8x C    26.7074  -13.0176
            23  C8y C    25.4915  -15.1105
            24  C7a C    26.2749  -18.0688
            25  C1a C    28.9583  -20.0098
            26  C8y C    25.4972  -13.7132
            27  O2x O    24.1585  -15.5431
            28  C1d C    25.5734  -19.2731
            29  O6a O    25.5674  -16.8527
            30  O2x O    24.1643  -13.2748
            31  C1x C    23.3342  -14.4031
            32  C1b C    24.1819  -19.2731
            33  O1a O    24.8718  -20.4833
            34  C1b C    23.4861  -20.4833
            35  C1d C    22.0946  -20.4833
            36  C1a C    21.3931  -21.6876
            37  C1a C    21.3873  -19.2674
            38  O1a O    20.6917  -20.4776
BOND        42
            1     2   5 1
            2     1   3 2
            3     1   2 1
            4     1   4 1
            5     6   7 1
            6     6   8 1
            7     6   9 1 #Up
            8     6  10 1 #Down
            9     7  11 1
            10    7  12 1
            11    8  13 1
            12    8  14 1
            13    9  15 2
            14   10  16 1
            15   11  17 2
            16   11  18 1
            17   12  19 1 #Up
            18   13  20 1
            19   15  21 1
            20   17  22 1
            21   18  23 2
            22   19  24 1
            23   21  25 1
            24   22  26 2
            25   23  27 1
            26   24  28 1
            27   24  29 2
            28   26  30 1
            29   27  31 1
            30   28  32 1
            31   28   4 1 #Down
            32   28  33 1 #Up
            33   32  34 1
            34   34  35 1
            35   35  36 1
            36   35  37 1
            37   35  38 1
            38   12  15 1
            39   14  16 1
            40   17  20 1
            41   23  26 1
            42   30  31 1

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