Entry |
|
Name |
Octadecanoic acid;
Stearate;
Stearic acid
|
Formula |
C18H36O2
|
Exact mass |
284.2715
|
Mol weight |
284.48
|
Structure |
|
Remark |
|
Reaction |
|
Pathway |
map01040 | Biosynthesis of unsaturated fatty acids |
map01060 | Biosynthesis of plant secondary metabolites |
|
Enzyme |
|
Brite |
Compounds with biological roles [BR:br08001]
Lipids
Fatty acids
Saturated fatty acids
C01530 Stearic acid (18:0)
Lipids [BR:br08002]
FA Fatty acyls
FA01 Fatty Acids and Conjugates
FA0101 Straight chain fatty acids
C01530 Octadecanoic acid
Phytochemical compounds [BR:br08003]
Fatty acids related compounds
Fatty acids
Saturated fatty acids
C01530 Stearic acid
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Stearic acid
D00119 Stearic acid (JP18/NF)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D00119 Stearic acid
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 20
1 C1b C 19.7116 -16.4984
2 C1b C 20.9283 -17.1928
3 C1b C 18.4889 -17.1928
4 C1b C 22.1388 -16.4984
5 C1b C 17.2784 -16.4984
6 C1b C 23.3556 -17.1928
7 C1b C 16.0618 -17.1928
8 C1b C 24.5660 -16.4984
9 C1b C 14.8513 -16.4984
10 C1b C 25.7888 -17.1928
11 C1b C 13.6286 -17.1928
12 C1b C 26.9993 -16.4984
13 C6a C 12.4179 -16.4984
14 C1b C 28.2160 -17.1928
15 O6a O 11.2013 -17.1989
16 C1b C 29.4264 -16.4984
17 C1b C 30.6493 -17.1928
18 C1b C 31.8598 -16.4984
19 C1a C 33.0763 -17.1928
20 O6a O 12.4167 -15.0958
BOND 19
1 18 19 1
2 1 2 1
3 1 3 1
4 2 4 1
5 3 5 1
6 4 6 1
7 5 7 1
8 6 8 1
9 7 9 1
10 8 10 1
11 9 11 1
12 10 12 1
13 11 13 1
14 12 14 1
15 13 15 1
16 14 16 1
17 16 17 1
18 17 18 1
19 13 20 2
|