KEGG   COMPOUND: C07185Help
Entry
C07185                      Compound                               

Name
Valproic acid
Formula
C8H16O2
Exact mass
144.115
Mol weight
144.2114
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Drug metabolism - cytochrome P450
Bile secretion
Enzyme
1.14.13.-
Brite
Target-based classification of compounds [BR:br08010]
 Enzymes
  Transferases
   4-aminobutyrate aminotransferase
    C07185  Valproic acid
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N03 ANTIEPILEPTICS
   N03A ANTIEPILEPTICS
    N03AG Fatty acid derivatives
     N03AG01 Valproic acid
      D00399  Valproic acid (USP)
USP drug classification [BR:br08302]
 Anticonvulsants
  Gamma-aminobutyric Acid (GABA) Augmenting Agents
   Valproate
    D00399  Valproic acid (USP)
 Antimigraine Agents
  Prophylactic
   Valproic acid
    D00399  Valproic acid (USP)
 Bipolar Agents
  Mood Stabilizers
   Valproic acid
    D00399  Valproic acid (USP)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated cation channels
   Ca2+ channel, CACN alpha-1, CaVx.x
    calcium channel T type
     Valproic acid
      D00399  Valproic acid (USP)
 Enzymes
  Transferases
   histone acetyltransferase
    Valproic acid
     D00399  Valproic acid (USP)
   GABA transaminase
    Valproic acid
     D00399  Valproic acid (USP)
  Hydrolases
   histone deacetylase
    Valproic acid
     D00399  Valproic acid (USP)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP2C9
   Valproic acid
    D00399  Valproic acid (USP)
  CYP3A4
   Valproic acid
    D00399  Valproic acid (USP)
BRITE hierarchy
Other DBs
CAS: 
99-66-1
PubChem: 
ChEBI: 
LIPIDMAPS: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        10
            1   C1c C    25.4573  -18.6784
            2   C1b C    25.4573  -17.3002
            3   C1b C    24.2485  -19.3967
            4   C6a C    26.6604  -19.3967
            5   C1b C    24.2427  -16.5935
            6   C1b C    23.0396  -18.6784
            7   O6a O    26.6604  -20.7925
            8   O6a O    27.8692  -18.6784
            9   C1a C    23.0339  -17.3002
            10  C1a C    21.8367  -19.3967
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6  10 1

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