KEGG   COMPOUND: C14585
Entry
C14585                      Compound                               
Name
4-Chlorochalcone;
3-(4-Chlorophenyl)-1-phenyl-2-propen-1-one
Formula
C15H11ClO
Exact mass
242.0498
Mol weight
242.7002
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1212 Chalcones and dihydrochalcones
    C14585  4-Chlorochalcone
Other DBs
CAS: 956-04-7
PubChem: 17395585
ChEBI: 34398
NIKKAJI: J39.611G
LinkDB
KCF data

ATOM        17
            1   C8x C    15.2600  -17.5000
            2   C8y C    15.2600  -16.1000
            3   C8x C    16.4500  -15.4000
            4   C8x C    17.7100  -16.1000
            5   C8y C    17.7100  -17.5000
            6   C8x C    16.4500  -18.2000
            7   X   Cl   14.0700  -15.4000
            8   C2b C    18.9000  -18.2000
            9   C2b C    20.0900  -17.5000
            10  C5a C    21.2800  -18.2000
            11  C8y C    22.4700  -17.5000
            12  O5a O    21.2800  -19.6000
            13  C8x C    22.4700  -16.1000
            14  C8x C    23.7300  -15.4000
            15  C8x C    24.9200  -16.1000
            16  C8x C    24.9200  -17.5000
            17  C8x C    23.7300  -18.2000
BOND        18
            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     2   7 1
            8     5   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 1
            12   10  12 2
            13   11  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   11  17 1

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