KEGG   COMPOUND: C10026
Entry
C10026                      Compound                               
Name
Carlinoside
Formula
C26H28O15
Exact mass
580.1428
Mol weight
580.4915
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10026  Carlinoside
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavones
    C10026  Carlinoside
Glycosides [BR:br08021]
 C-glycosides
  C10026  Carlinoside
Other DBs
CAS: 59952-97-5
PubChem: 12212
ChEBI: 3421
LIPIDMAPS: LMPK12110488
KNApSAcK: C00006184
3DMET: B03470
NIKKAJI: J1.319.352E
LinkDB
KCF data

ATOM        41
            1   C1y C    22.1137  -11.4101
            2   C1y C    22.1137  -12.8049
            3   C1y C    23.3245  -13.5023
            4   O2x O    24.5283  -12.8049
            5   C1x C    24.5283  -11.4101
            6   C1y C    23.3245  -10.7127
            7   C8y C    23.3262  -14.8970
            8   C8y C    24.5300  -15.5988
            9   C8y C    24.5242  -16.9980
            10  O2x O    25.7484  -14.9050
            11  C8y C    22.1047  -15.5988
            12  C8y C    23.3232  -17.7034
            13  C8y C    25.7368  -17.7093
            14  C8y C    26.9610  -15.6046
            15  C8y C    22.1047  -16.9980
            16  O1a O    20.8922  -14.8992
            17  O1a O    23.3291  -19.1026
            18  C8x C    26.9552  -17.0097
            19  O5x O    25.7309  -19.1083
            20  C8y C    28.1794  -14.9167
            21  C1y C    20.8922  -17.7034
            22  C8x C    28.1794  -13.5176
            23  C8x C    29.3862  -15.6222
            24  O2x O    19.6795  -16.9980
            25  C1y C    20.8922  -19.1026
            26  C8y C    29.3979  -12.8180
            27  C8x C    30.6047  -14.9283
            28  C1y C    18.4610  -17.7034
            29  C1y C    19.6795  -19.8022
            30  O1a O    22.1047  -19.8022
            31  C8y C    30.6106  -13.5234
            32  O1a O    29.4038  -11.4129
            33  C1y C    18.4610  -19.1026
            34  C1b C    17.2485  -16.9980
            35  O1a O    19.6854  -21.2013
            36  O1a O    31.8289  -12.8297
            37  O1a O    17.2485  -19.8022
            38  O1a O    16.0360  -17.6976
            39  O1a O    20.9061  -13.5028
            40  O1a O    20.9061  -10.7120
            41  O1a O    23.3262   -9.3179
BOND        45
            1     3   4 1
            2     4   5 1
            3     5   6 1
            4     6   1 1
            5     3   7 1 #Up
            6     8   7 1
            7     8   9 2
            8     8  10 1
            9     7  11 2
            10    9  12 1
            11    9  13 1
            12   10  14 1
            13   11  15 1
            14   11  16 1
            15   12  17 1
            16   13  18 1
            17   13  19 2
            18   14  20 1
            19   21  15 1 #Up
            20   20  22 1
            21   20  23 2
            22   21  24 1
            23   21  25 1
            24   22  26 2
            25   23  27 1
            26   24  28 1
            27   25  29 1
            28   25  30 1 #Down
            29   26  31 1
            30   26  32 1
            31   28  33 1
            32   28  34 1 #Up
            33   29  35 1 #Up
            34   31  36 1
            35   33  37 1 #Down
            36   34  38 1
            37   12  15 2
            38   14  18 2
            39   27  31 2
            40   29  33 1
            41    2  39 1 #Down
            42    1   2 1
            43    1  40 1 #Up
            44    2   3 1
            45    6  41 1 #Up

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