COMPOUND: C20324
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Entry
C20324 Compound
Name
[(1S)-4-Hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate
Formula
C10H16O3
Exact mass
184.1099
Mol weight
184.23
Structure
Mol file
KCF file
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Reaction
R10051
Pathway
map00907
Pinene, camphor and geraniol degradation
Enzyme
3.7.1.18
Other DBs
PubChem:
163312062
ChEBI:
181383
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KCF data
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ATOM 13
1 C1b C 15.5800 -25.7765
2 C6a C 16.8378 -25.0777
3 O6a O 18.0257 -25.7765
4 O6a O 16.8378 -23.6801
5 C1y C 14.3921 -25.0777
6 C1z C 13.0644 -25.7765
7 C1x C 14.0427 -23.7500
8 C1y C 12.0861 -24.8681
9 C1a C 13.8330 -26.9644
10 C1a C 12.4355 -26.9644
11 C5x C 12.6451 -23.6103
12 C1a C 10.6886 -25.1476
13 O5x O 11.9392 -22.3959
BOND 13
1 1 2 1
2 2 3 1
3 2 4 2
4 5 1 1 #Up
5 5 6 1
6 5 7 1
7 6 8 1
8 6 9 1
9 6 10 1
10 7 11 1
11 8 12 1
12 8 11 1
13 11 13 2
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