COMPOUND: C18020
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Entry
C18020 Compound
Name
p-Menth-8-ene-1,2-diol;
1-Methyl-4-(1-methylethenyl)-1,2-cyclohexanediol;
Menth-8-ene-1,2-diol
Formula
C10H18O2
Exact mass
170.1307
Mol weight
170.2487
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
C18020 p-Menth-8-ene-1,2-diol
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Other DBs
CAS:
1946-00-5
PubChem:
96024240
ChEBI:
17219
KNApSAcK:
C00010924
NIKKAJI:
J199.764E
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KCF data
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ATOM 12
1 C1x C 26.6564 -22.9736
2 C1x C 26.6564 -24.3776
3 C1y C 27.8762 -25.0829
4 C1x C 29.0886 -24.3776
5 C1y C 29.0886 -22.9736
6 C1z C 27.8762 -22.2752
7 O1a O 30.2988 -22.2760
8 C2c C 27.8779 -26.4870
9 C1a C 26.6620 -27.1869
10 C2a C 29.0955 -27.1839
11 C1a C 26.8013 -21.4332
12 O1a O 28.8685 -21.2829
BOND 12
1 5 6 1
2 6 1 1
3 1 2 1
4 5 7 1
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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