KEGG   COMPOUND: C09312
Entry
C09312                      Compound                               

Name
Seselin
Formula
C14H12O3
Exact mass
228.0786
Mol weight
228.2433
Structure
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Coumarins
   Coumarins
    C09312  Seselin
Other DBs
CAS: 523-59-1
PubChem: 11503
ChEBI: 69040
ChEMBL: CHEMBL71358
KNApSAcK: C00000300
3DMET: B02852
NIKKAJI: J11.874E
KCF data

ATOM        17
            1   C8y C    28.8400  -17.2200
            2   C8y C    27.6500  -16.5200
            3   C8y C    28.8400  -18.6200
            4   O7x O    30.0300  -16.5200
            5   C8y C    26.3900  -17.2200
            6   C2x C    27.6500  -15.1200
            7   C8x C    27.6500  -19.3200
            8   C8x C    30.0300  -19.3200
            9   C8y C    31.2900  -17.2200
            10  C8x C    26.3900  -18.6200
            11  O2x O    25.2000  -16.5200
            12  C2x C    26.4600  -14.4200
            13  C8x C    31.2900  -18.6200
            14  O6a O    32.4800  -16.5200
            15  C1z C    25.2000  -15.1200
            16  C1a C    24.1500  -14.0700
            17  C1a C    24.0800  -15.8900
BOND        19
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    6  12 2
            12    8  13 2
            13    9  14 2
            14   11  15 1
            15   15  16 1
            16   15  17 1
            17    7  10 2
            18    9  13 1
            19   12  15 1

» Japanese version

DBGET integrated database retrieval system