KEGG   COMPOUND: C16409
Entry
C16409                      Compound                               

Name
Aureusidin 6-O-glucoside;
Aureusidin 6-O-beta-D-glucoside
Formula
C21H20O11
Exact mass
448.1006
Mol weight
448.3769
Structure
Reaction
Pathway
map00941  Flavonoid biosynthesis
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Aurones
    C16409  Aureusidin 6-O-glucoside
Other DBs
CAS: 633-15-8
PubChem: 47205707
ChEBI: 66905
ChEMBL: CHEMBL2417912
KNApSAcK: C00008046
NIKKAJI: J37.392C
KCF data

ATOM        32
            1   C8y C    13.3000  -18.5500
            2   C8x C    13.3000  -19.9500
            3   C8y C    14.5124  -20.6500
            4   C8y C    15.7249  -19.9500
            5   C8y C    15.7249  -18.5500
            6   C8x C    14.5124  -17.8500
            7   C5x C    17.0564  -20.3826
            8   C2y C    17.8793  -19.2500
            9   O2x O    17.0564  -18.1174
            10  C2b C    19.2500  -19.2500
            11  C8y C    19.9500  -18.0376
            12  C8x C    21.3498  -18.0376
            13  C8y C    22.0498  -16.8251
            14  C8y C    21.3498  -15.6127
            15  C8x C    19.9500  -15.6127
            16  C8x C    19.2500  -16.8251
            17  O1a O    23.4498  -16.8251
            18  O1a O    22.0510  -14.3982
            19  O5x O    17.4875  -21.7094
            20  O1a O    14.5124  -22.0498
            21  O2a O    12.0876  -17.8500
            22  C1y C    10.8921  -18.5404
            23  O2x O     9.7047  -17.8549
            24  C1y C     8.4923  -18.5550
            25  C1y C     8.4924  -19.9550
            26  C1y C     9.6797  -20.6404
            27  C1y C    10.8921  -19.9404
            28  C1b C     7.2610  -17.8440
            29  O1a O     9.6799  -22.0499
            30  O1a O     7.2655  -20.6636
            31  O1a O    12.1296  -20.6549
            32  O1a O     6.0603  -18.5373
BOND        35
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 1
            11    8  10 2
            12   10  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   13  17 1
            20   14  18 1
            21    7  19 2
            22    3  20 1
            23    1  21 1
            24   22  21 1 #Up
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   22  27 1
            31   24  28 1 #Up
            32   26  29 1 #Up
            33   25  30 1 #Down
            34   27  31 1 #Down
            35   28  32 1

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