KEGG   COMPOUND: C04552
Entry
C04552                      Compound                               
Name
Chrysosplenol D;
3',4',5-Trihydroxy-3,6,7-trimethoxyflavone
Formula
C18H16O8
Exact mass
360.0845
Mol weight
360.3148
Structure
Reaction
R04505
Enzyme
2.1.1.84
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C04552  Chrysosplenol D
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavonols
    C04552  Chrysosplenol D
Other DBs
CAS: 14965-20-9
PubChem: 7157
ChEBI: 18016
LIPIDMAPS: LMPK12112998
KNApSAcK: C00004692
3DMET: B00731
NIKKAJI: J14.308A
KCF data

ATOM        26
            1   C8y C    17.4300  -17.7100
            2   C8y C    17.4300  -16.3100
            3   C8y C    18.6200  -18.4800
            4   C8y C    16.1700  -18.4100
            5   O2x O    18.6200  -15.6100
            6   C8x C    16.1700  -15.6100
            7   C8y C    19.8800  -17.7100
            8   O5x O    18.6200  -19.8100
            9   C8y C    14.9800  -17.7100
            10  O1a O    16.1700  -19.8100
            11  C8y C    19.8800  -16.3100
            12  C8y C    14.9800  -16.3100
            13  O2a O    21.0700  -18.4800
            14  O2a O    13.7900  -18.4100
            15  C8y C    21.0700  -15.6100
            16  O2a O    13.7900  -15.6100
            17  C1a C    22.2600  -17.7800
            18  C8x C    21.0700  -14.2100
            19  C8x C    22.2600  -16.3100
            20  C1a C    12.6000  -16.3100
            21  C8y C    22.2600  -13.5100
            22  C8x C    23.5200  -15.6100
            23  C8y C    23.5200  -14.2100
            24  O1a O    22.2600  -12.1100
            25  O1a O    24.7100  -13.5100
            26  C1a C    12.5719  -17.7199
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 1
            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   16  20 1
            20   18  21 2
            21   19  22 1
            22   21  23 1
            23   21  24 1
            24   23  25 1
            25    7  11 2
            26    9  12 2
            27   22  23 2
            28   14  26 1

» Japanese version

  All links  
Chemical substance (6)   
   PubChem (1)   
   ChEBI (1)   
   3DMET (1)   
   KNApSAcK (1)   
   LIPIDMAPS (1)   
   NIKKAJI (1)   
Chemical reaction (2)   
   KEGG ENZYME (1)   
   KEGG REACTION (1)   
All databases (8)   

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