COMPOUND: C15494
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Entry
C15494 Compound
Name
Decylubiquinone;
6-Decylubiquinone;
2,3-Dimethoxy-5-methyl-6-decyl-1,4-benzoquinone
Formula
C19H30O4
Exact mass
322.2144
Mol weight
322.4391
Structure
Mol file
KCF file
DB search
Reaction
R07177
Enzyme
1.8.5.2
Other DBs
CAS:
55486-00-5
PubChem:
17396486
ChEBI:
52020
PDB-CCD:
DCQ
[
PDBj
]
NIKKAJI:
J668.940J
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KCF data
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ATOM 23
1 C2y C 26.3125 -20.9323
2 C5x C 25.1000 -21.6396
3 C2y C 26.3125 -19.5279
4 C2y C 23.8932 -20.9323
5 O5x O 25.1000 -23.0323
6 C5x C 25.1000 -18.8252
7 C1a C 27.5195 -18.8252
8 C2y C 23.8932 -19.5279
9 O2a O 22.6852 -21.6222
10 O5x O 25.1000 -17.4382
11 O2a O 22.6909 -18.8252
12 C1a C 21.4782 -20.9207
13 C1a C 22.6983 -17.4426
14 C1b C 27.5324 -21.6300
15 C1b C 28.7449 -20.9300
16 C1b C 29.9573 -21.6300
17 C1b C 31.1697 -20.9300
18 C1b C 32.3822 -21.6300
19 C1b C 33.5946 -20.9300
20 C1b C 34.8070 -21.6300
21 C1b C 36.0195 -20.9300
22 C1b C 37.2319 -21.6300
23 C1a C 38.4444 -20.9300
BOND 23
1 3 6 1
2 3 7 1
3 4 8 2
4 4 9 1
5 6 10 2
6 8 11 1
7 9 12 1
8 6 8 1
9 1 2 1
10 1 3 2
11 2 4 1
12 2 5 2
13 11 13 1
14 1 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 22 23 1
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