KEGG   COMPOUND: C01624Help
Entry
C01624                      Compound                               

Name
Vermelone;
3,4-Dihydro-3,8-dihydroxy-1(2H)-naphthalenone
Formula
C10H10O3
Exact mass
178.063
Mol weight
178.1846
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
Other DBs
CAS: 59796-04-2
PubChem: 4775
ChEBI: 9957
NIKKAJI: J435.272F
KCF data Show

ATOM        13
            1   C8y C    25.9705  -21.3857
            2   C8y C    25.9646  -22.7889
            3   C5x C    27.1875  -20.6985
            4   C8y C    24.7593  -20.6928
            5   C1x C    27.1759  -23.4936
            6   C8x C    24.7593  -23.4936
            7   C1x C    28.3986  -21.3973
            8   O5x O    27.1933  -19.2953
            9   C8x C    23.5422  -21.3857
            10  O1a O    24.7652  -19.2953
            11  C1y C    28.3929  -22.7948
            12  C8x C    23.5422  -22.7889
            13  O1a O    29.5983  -23.4994
BOND        14
            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   11  13 1
            13    7  11 1
            14    9  12 2

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