C00033


Entry
C00033                      Compound                               
Name
Acetate;
Acetic acid;
Ethanoic acid
Formula
C2H4O2
Exact mass
60.0211
Mol weight
60.052
Structure
Remark
Same as: D00010
Reaction
R00227 R00229 R00235 R00315 R00316 R00317 R00318 R00319
R00320 R00321 R00322 R00324 R00325 R00326 R00327 R00338
R00362 R00393 R00458 R00488 R00628 R00651 R00669 R00710
R00711 R00743 R00897 R00909 R00928 R01019 R01026 R01156
R01179 R01200 R01241 R01287 R01308 R01323 R01359 R01426
R01649 R01810 R01987 R02026 R02059 R02276 R02333 R02733
R02942 R02955 R03062 R03131 R03132 R03133 R03134 R03145
R03153 R03217 R03482 R03601 R03884 R04000 R04043 R04056
R04057 R04091 R04141 R04146 R04174 R04397 R04449 R04450
R04452 R04490 R04525 R04587 R04727 R04769 R04859 R04945
R05138 R05168 R05219 R05336 R05508 R05509 R05677 R05880
R05917 R06241 R06893 R07183 R07300 R07301 R07342 R07513
R07832 R08090 R08206 R08517 R08518 R08600 R08601 R08874
R08876 R08895 R08901 R08944 R09107 R09475 R09483 R09651
R09721 R09801 R09931 R10248 R10249 R10289 R10305 R10343
R10398 R10401 R10461 R10553 R10600 R10614 R10705 R10839
R10840 R11116 R11283 R11693 R11694 R11889 R11903 R12347
R12390 R12391 R12392 R12515 R12516 R12635 R12671 R12926
 » show all
Pathway
map00010  Glycolysis / Gluconeogenesis
map00430  Taurine and hypotaurine metabolism
map00440  Phosphonate and phosphinate metabolism
map00534  Glycosaminoglycan biosynthesis - heparan sulfate / heparin
map00620  Pyruvate metabolism
map00630  Glyoxylate and dicarboxylate metabolism
map00660  C5-Branched dibasic acid metabolism
map00680  Methane metabolism
map00720  Carbon fixation pathways in prokaryotes
map00908  Zeatin biosynthesis
map00920  Sulfur metabolism
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01120  Microbial metabolism in diverse environments
map01200  Carbon metabolism
map01220  Degradation of aromatic compounds
map04725  Cholinergic synapse
map04936  Alcoholic liver disease
map04973  Carbohydrate digestion and absorption
map04974  Protein digestion and absorption
Module
M00357  Methanogenesis, acetate => methane
M00579  Phosphate acetyltransferase-acetate kinase pathway, acetyl-CoA => acetate
Enzyme
1.1.1.318       1.1.1.319       1.2.1.3         1.2.1.4         
1.2.1.5         1.2.1.-         1.2.5.1         1.2.5.2         
1.2.99.6        1.13.11.50      1.13.12.4       1.14.13.54      
1.14.14.32      2.1.1.152       2.3.1.187       2.5.1.47        
2.5.1.48        2.5.1.49        2.5.1.50        2.5.1.51        
2.5.1.52        2.5.1.53        2.5.1.65        2.5.1.118       
2.5.1.119       2.5.1.134       2.5.1.144       2.6.99.3        
2.7.2.1         2.7.2.12        2.7.2.15        2.8.3.1         
2.8.3.3         2.8.3.8         2.8.3.10        2.8.3.11        
2.8.3.12        2.8.3.14        2.8.3.18        2.8.3.19        
2.8.3.-         3.1.1.2         3.1.1.6         3.1.1.7         
3.1.1.8         3.1.1.33        3.1.1.41        3.1.1.47        
3.1.1.53        3.1.1.54        3.1.1.55        3.1.1.56        
3.1.1.58        3.1.1.66        3.1.1.71        3.1.1.80        
3.1.1.94        3.1.1.105       3.1.1.106       3.1.1.112       
3.1.1.113       3.1.1.114       3.1.2.1         3.1.2.16        
3.5.1.4         3.5.1.14        3.5.1.15        3.5.1.16        
3.5.1.17        3.5.1.21        3.5.1.25        3.5.1.29        
3.5.1.33        3.5.1.41        3.5.1.47        3.5.1.48        
3.5.1.51        3.5.1.62        3.5.1.63        3.5.1.66        
3.5.1.76        3.5.1.85        3.5.1.89        3.5.1.103       
3.5.1.104       3.5.1.105       3.5.1.108       3.5.1.112       
3.5.1.113       3.5.1.114       3.5.1.125       3.5.1.135       
3.5.1.136       3.5.1.-         3.6.1.7         3.6.1.20        
3.7.1.1         3.7.1.6         3.7.1.24        3.7.1.25        
3.11.1.2        4.1.1.88        4.1.3.4         4.1.3.6         
4.1.3.22        4.1.3.26        4.2.99.24       6.2.1.1         
6.2.1.13        6.2.1.22        6.2.1.35
 » show all
Brite
Compounds with biological roles [BR:br08001]
 Organic acids
  Carboxylic acids
   Monocarboxylic acids
    C00033  Acetate; Ethanoate
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0101 Straight chain fatty acids
    C00033  Acetic acid
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AD Organic acids
     G01AD02 Acetic acid
      D00010  Acetic acid, glacial (USP) <JP/US>
 S SENSORY ORGANS
  S02 OTOLOGICALS
   S02A ANTIINFECTIVES
    S02AA Antiinfectives
     S02AA10 Acetic acid
      D00010  Acetic acid, glacial (USP) <JP/US>
USP drug classification [BR:br08302]
 Antibacterials
  Antibacterials, Other
   Acetic Acid
    D00010  Acetic acid, glacial (USP)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  26  Epidermides
   264  Analgesics, anti-itchings, astringents, anti-inflammatory agents
    2649  Others
     D00010  Acetic acid, glacial (USP); Acetic acid (JP18/NF); Glacial acetic acid (JP18)
   266  Emollients
    2661  Organic acids
     D00010  Acetic acid, glacial (USP); Acetic acid (JP18/NF); Glacial acetic acid (JP18)
 7  Agents not mainly for therapeutic purpose
  71  Dispensing medicines
   714  Flavorings, deodorants, coloring agents
    7149  Others
     D00010  Acetic acid, glacial (USP); Acetic acid (JP18/NF); Glacial acetic acid (JP18)
   719  Miscellaneous
    7190  Miscellaneous
     D00010  Acetic acid, glacial (USP); Acetic acid (JP18/NF); Glacial acetic acid (JP18)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Acetic acid
    D00010  Acetic acid, glacial (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00010  Acetic acid
  D00010  Glacial acetic acid
Other DBs
CAS: 64-19-7
PubChem: 3335
ChEBI: 15366 30089
LIPIDMAPS: LMFA01010002
KNApSAcK: C00001176
PDB-CCD: ACT[PDBj] ACY[PDBj]
3DMET: B00009
NIKKAJI: J2.355H
KCF data

ATOM        4
            1   C6a C    24.5700  -15.7500
            2   C1a C    25.7840  -16.4527
            3   O6a O    23.3619  -16.4527
            4   O6a O    24.5700  -14.3503
BOND        3
            1     1   2 1
            2     1   3 1
            3     1   4 2