KEGG   COMPOUND: C23142
Entry
C23142                      Compound                               
Name
(Z,S)-Cinerolone
Formula
C10H14O2
Exact mass
166.0994
Mol weight
166.22
Structure
Reaction
R13651 R13665 R13668
Pathway
map00592  alpha-Linolenic acid metabolism
Other DBs
PubChem: 528798992
LinkDB
KCF data

ATOM        12
            1   C2y C    16.5178  -15.3330
            2   C2y C    16.5178  -16.6572
            3   C5x C    15.1936  -14.9148
            4   C1b C    17.9117  -14.0785
            5   C1y C    15.2633  -17.0754
            6   C1a C    17.7026  -17.3541
            7   C1x C    14.4270  -16.0299
            8   O5x O    14.7755  -13.5210
            9   C2b C    19.0965  -14.7755
            10  C2b C    20.4904  -14.7755
            11  C1a C    21.6055  -14.0785
            12  O1a O    14.9148  -18.3995
BOND        12
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     9  10 2
            10   10  11 1
            11    5   7 1
            12    5  12 1 #Up

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