KEGG   COMPOUND: C01066Help
Entry
C01066                      Compound                               

Name
Cyclohexane-1,3-dione;
1,3-Cyclohexanedione;
Dihydroresorcinol
Formula
C6H8O2
Exact mass
112.0524
Mol weight
112.1265
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
1.1.99.26       3.7.1.10
Other DBs
CAS: 504-02-9
PubChem: 4305
ChEBI: 17766
ChEMBL: CHEMBL363919
3DMET: B00234
NIKKAJI: J6.214F
LinkDB All DBs
KCF data Show

ATOM        8
            1   C1x C    22.7551  -16.1289
            2   C5x C    22.7551  -17.5366
            3   C5x C    21.5329  -15.4313
            4   C1x C    21.5329  -18.2470
            5   O5x O    23.9581  -18.2277
            6   C1x C    20.3298  -16.1289
            7   O5x O    21.5264  -14.1129
            8   C1x C    20.3298  -17.5366
BOND        8
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 2
            7     4   8 1
            8     6   8 1

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