KEGG   COMPOUND: C10832Help
Entry
C10832                      Compound                               

Name
Sesamol
Formula
C7H6O3
Exact mass
138.0317
Mol weight
138.1207
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 533-31-3
PubChem: 13015
ChEBI: 9126
ChEMBL: CHEMBL1517998
KNApSAcK: C00002673
PDB-CCD: BZX[PDBj]
3DMET: B04166
NIKKAJI: J1.589J
LinkDB All DBs
KCF data Show

ATOM        10
            1   C1x C    14.3866  -24.2312
            2   O2x O    15.1911  -25.3770
            3   C8y C    16.5294  -24.9658
            4   C8y C    16.5520  -23.5660
            5   O2x O    15.2276  -23.1120
            6   C8x C    17.7304  -25.6853
            7   C8x C    18.9540  -25.0049
            8   C8y C    18.9765  -23.6050
            9   C8x C    17.7755  -22.8856
            10  O1a O    20.2014  -22.9239
BOND        11
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     3   6 2
            7     6   7 1
            8     7   8 2
            9     8   9 1
            10    4   9 2
            11    8  10 1

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