KEGG   COMPOUND: C10042
Entry
C10042                      Compound                               
Name
Fisetin 8-C-glucoside
Formula
C21H20O11
Exact mass
448.1006
Mol weight
448.3769
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10042  Fisetin 8-C-glucoside
Glycosides [BR:br08021]
 C-glycosides
  C10042  Fisetin 8-C-glucoside
Other DBs
CAS: 108335-27-9
PubChem: 12228
ChEBI: 5065
LIPIDMAPS: LMPK12111554
KNApSAcK: C00001039
3DMET: B03485
NIKKAJI: J2.771.634B
LinkDB
KCF data

ATOM        32
            1   C1y C    23.7226  -16.7384
            2   C1y C    23.7226  -18.1344
            3   C1y C    24.9345  -18.8324
            4   O2x O    26.1393  -18.1344
            5   C1y C    26.1393  -16.7384
            6   C1y C    24.9345  -16.0404
            7   C8y C    24.9364  -20.2285
            8   C8y C    26.1542  -20.9387
            9   C8y C    23.7268  -20.9387
            10  C8y C    26.1483  -22.3391
            11  O2x O    27.3736  -20.2385
            12  C8x C    23.7268  -22.3391
            13  O1a O    22.5189  -20.2327
            14  C8y C    27.3621  -23.0451
            15  C8x C    24.9464  -23.0394
            16  C8y C    28.5874  -20.9446
            17  C8y C    28.5815  -22.3508
            18  O5x O    27.3562  -24.4455
            19  C8y C    29.8070  -20.2501
            20  O1a O    29.7953  -23.0510
            21  C8x C    29.8127  -18.8497
            22  C8x C    31.0148  -20.9620
            23  C8y C    31.0323  -18.1554
            24  C8x C    32.2284  -20.2618
            25  C8y C    32.2344  -18.8556
            26  O1a O    31.0382  -16.7492
            27  O1a O    33.4539  -18.1671
            28  O1a O    22.5140  -18.8331
            29  O1a O    22.5140  -16.0399
            30  O1a O    24.9364  -14.6443
            31  C1b C    27.3489  -16.0414
            32  O1a O    27.3499  -14.6453
BOND        35
            1     2   3 1
            2     3   4 1
            3     4   5 1
            4     8  10 2
            5     8  11 1
            6     9  12 1
            7     9  13 1
            8    10  14 1
            9    10  15 1
            10   11  16 1
            11   14  17 1
            12   14  18 2
            13   16  19 1
            14   17  20 1
            15   19  21 1
            16   19  22 2
            17   21  23 2
            18   22  24 1
            19   23  25 1
            20   23  26 1
            21   25  27 1
            22   12  15 2
            23   16  17 2
            24   24  25 2
            25    7   8 1
            26    7   9 2
            27    5   6 1
            28    2  28 1 #Down
            29    6   1 1
            30    1  29 1 #Up
            31    6  30 1 #Down
            32    3   7 1 #Up
            33    5  31 1 #Up
            34    1   2 1
            35   31  32 1

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