KEGG   COMPOUND: C17462
Entry
C17462                      Compound                               
Name
Alismol
Formula
C15H24O
Exact mass
220.1827
Mol weight
220.3505
Structure
Other DBs
CAS: 87827-55-2
PubChem: 96023810
ChEBI: 81106
KNApSAcK: C00020395
NIKKAJI: J503.091I
LinkDB
KCF data

ATOM        16
            1   C1y C    27.1893  -19.7084
            2   C2y C    28.4437  -19.1074
            3   C1x C    29.7036  -19.7076
            4   C1x C    30.0158  -21.0571
            5   C1y C    26.8825  -21.0784
            6   C2y C    29.1555  -22.1584
            7   C2x C    27.7592  -22.1639
            8   C2a C    28.4422  -17.7156
            9   C1x C    26.1206  -18.9932
            10  C1x C    24.9276  -19.7818
            11  C1z C    25.4847  -21.1403
            12  O1a O    24.7716  -22.4149
            13  C1a C    24.0698  -21.0507
            14  C1c C    29.7787  -23.4294
            15  C1a C    31.1789  -23.4546
            16  C1a C    29.0299  -24.6066
BOND        17
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 2
            8     2   8 2
            9     1   9 1
            10    9  10 1
            11   10  11 1
            12    5  11 1
            13   11  12 1 #Down
            14   11  13 1 #Up
            15    6  14 1
            16   14  15 1
            17   14  16 1

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