COMPOUND: C18019
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Entry
C18019 Compound
Name
1-Hydroxy-p-menth-8-en-2-one;
2-Hydroxy-2-methyl-5-(1-methylethenyl)cyclohexanone;
1-Hydroxymenth-8-en-2-one
Formula
C10H16O2
Exact mass
168.115
Mol weight
168.2328
Structure
Mol file
KCF file
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Reaction
R08919
Enzyme
1.1.1.297
Brite
Lipids [BR:
br08002
]
PR Prenol lipids
PR01 Isoprenoids
PR0102 C10 isoprenoids (monoterpenes)
PR010209 Menthane monoterpenoids
C18019 1-Hydroxy-p-menth-8-en-2-one
BRITE hierarchy
Other DBs
PubChem:
96024239
ChEBI:
50246
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KCF data
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ATOM 12
1 C1x C 26.6649 -23.2001
2 C1x C 26.6649 -24.6009
3 C1y C 27.8819 -25.3046
4 C1x C 29.0915 -24.6009
5 C5x C 29.0915 -23.2001
6 C1z C 27.8819 -22.5033
7 O5x O 30.2990 -22.5041
8 C2c C 27.8836 -26.7054
9 C1a C 26.6705 -27.4037
10 C2a C 29.0984 -27.4007
11 C1a C 26.8095 -21.6633
12 O1a O 28.8719 -21.5133
BOND 12
1 5 6 1
2 6 1 1
3 1 2 1
4 5 7 2
5 2 3 1
6 3 8 1
7 3 4 1
8 8 9 1
9 4 5 1
10 8 10 2
11 6 11 1
12 6 12 1
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