KEGG   COMPOUND: C13687
Entry
C13687                      Compound                               
Name
Cunaniol
Formula
C14H14O2
Exact mass
214.0994
Mol weight
214.2598
Structure
Other DBs
CAS: 20110-36-5
PubChem: 586276
ChEBI: 34657
KNApSAcK: C00001286
NIKKAJI: J2.786.082F
LinkDB
KCF data

ATOM        16
            1   C1x C    21.3721  -16.7195
            2   C1x C    21.3721  -18.1216
            3   O2x O    22.5893  -18.8227
            4   C1y C    23.7993  -18.1216
            5   C1y C    23.7993  -16.7195
            6   C1x C    22.5893  -16.0185
            7   C2b C    25.0048  -18.8227
            8   C2b C    26.2157  -18.1147
            9   C3b C    27.4266  -18.8157
            10  C3b C    28.6376  -19.5168
            11  C3b C    29.8485  -20.2178
            12  C3b C    31.0594  -20.9189
            13  C3b C    32.2703  -21.6199
            14  C3b C    33.4812  -22.3209
            15  C1a C    34.6921  -23.0220
            16  O1a O    25.0048  -16.0115
BOND        16
            1     7   8 2
            2     2   3 1
            3     8   9 1
            4     3   4 1
            5     9  10 3
            6     4   5 1
            7    10  11 1
            8     5   6 1
            9    11  12 3
            10    6   1 1
            11   12  13 1
            12   13  14 3
            13    4   7 1 #Down
            14   14  15 1
            15    1   2 1
            16    5  16 1 #Up

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