KEGG   COMPOUND: C19084
Entry
C19084                      Compound                               

Name
(4S)-7-Hydroxy-4-isopropenyl-7-methyl-2-oxo-oxepanone;
(4S)-7-Hydroxy-4-isopropenyl-7-methyloxepan-2-one
Formula
C10H16O3
Exact mass
184.1099
Mol weight
184.2322
Structure
Reaction
Pathway
map00903  Limonene and pinene degradation
Enzyme
Other DBs
PubChem: 124489756
ChEBI: 82207
LinkDB
KCF data

ATOM        13
            1   C1z C    15.5400  -12.6000
            2   O7x O    16.9400  -12.6000
            3   C1x C    14.5501  -13.5899
            4   C7x C    17.9299  -13.5899
            5   C1x C    17.5676  -14.9422
            6   C1x C    14.9124  -14.9422
            7   C1y C    16.1248  -15.6422
            8   O1a O    15.5400  -11.2000
            9   C1a C    14.1877  -12.2377
            10  O6a O    19.3299  -13.5899
            11  C2c C    16.1248  -17.0422
            12  C1a C    14.9124  -17.7422
            13  C2a C    17.3372  -17.7422
BOND        13
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     4   5 1
            5     3   6 1
            6     6   7 1
            7     7   5 1
            8     1   8 1
            9     1   9 1
            10    4  10 2
            11    7  11 1 #Up
            12   11  12 1
            13   11  13 2

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