KEGG   COMPOUND: C10118Help
Entry
C10118                      Compound                               

Name
Patuletin;
Quercetagetin 6-methyl ether
Formula
C16H12O8
Exact mass
332.0532
Mol weight
332.2617
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10118  Patuletin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavonols
    C10118  Patuletin
BRITE hierarchy
Other DBs
CAS: 
519-96-0
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C8y C    23.6138  -19.2378
            2   C8y C    23.6197  -17.8383
            3   C8y C    22.4067  -19.9376
            4   C8y C    24.8266  -19.9435
            5   O2x O    24.8383  -17.1387
            6   C8x C    22.4067  -17.1328
            7   C8y C    21.1996  -19.2378
            8   O1a O    22.4126  -21.3314
            9   C8y C    26.0454  -19.2495
            10  O5x O    24.8209  -21.3371
            11  C8y C    26.0513  -17.8500
            12  C8y C    21.1996  -17.8383
            13  O2a O    19.9925  -19.9376
            14  O1a O    27.2467  -19.9552
            15  C8y C    27.2701  -17.1502
            16  O1a O    19.9868  -17.1445
            17  C1a C    18.7797  -19.2378
            18  C8x C    27.2701  -15.7449
            19  C8x C    28.4829  -17.8559
            20  C8y C    28.4888  -15.0452
            21  C8x C    29.6959  -17.1561
            22  C8y C    29.7017  -15.7509
            23  O1a O    28.4888  -13.6516
            24  O1a O    30.9145  -15.0568
BOND        26
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    6  12 2
            12    7  13 1
            13    9  14 1
            14   11  15 1
            15   12  16 1
            16   13  17 1
            17   15  18 1
            18   15  19 2
            19   18  20 2
            20   19  21 1
            21   20  22 1
            22   20  23 1
            23   22  24 1
            24    7  12 1
            25    9  11 2
            26   21  22 2

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