KEGG   COMPOUND: C06866Help
Entry
C06866                      Compound                               

Name
Capsaicin
Formula
C18H27NO3
Exact mass
305.1991
Mol weight
305.4119
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Phenylalanine metabolism
Biosynthesis of plant secondary metabolites
Biosynthesis of alkaloids derived from shikimate pathway
Metabolic pathways
Biosynthesis of secondary metabolites
Inflammatory mediator regulation of TRP channels
Module
M00350  
Capsaicin biosynthesis, L-Phenylalanine => Capsaicin
Brite
Phytochemical compounds [BR:br08003]
 Amino acid related compounds
  Others
   Capsaicinoids and derivatives
    C06866  Capsaicin
Target-based classification of compounds [BR:br08010]
 Ion channels
  Related to voltage-gated cation channels
   Transient receptor potential family, TRPV (Vanilloid)
    transient receptor potential cation channel, subfamily V, member 1
     C06866  Capsaicin
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M02 TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
   M02A TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
    M02AB Capsaicin and similar agents
     M02AB01 Capsaicin
      D00250  Capsaicin (JAN/USP)
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01B ANESTHETICS, LOCAL
    N01BX Other local anesthetics
     N01BX04 Capsaicin
      D00250  Capsaicin (JAN/USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Category 3
  Inorganic and organic chemicals
   Capsaicin
    D00250  Capsaicin (JAN/USP)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Related to voltage-gated cation channels
   Transient receptor potential family, TRPV (Vanilloid)
    transient receptor potential cation channel, subfamily V, member 1 (TRPV1)
     Capsaicin
      D00250  Capsaicin (JAN/USP)
Major components of natural products [BR:br08323]
 Crude drugs
  Capsicum
   C06866  Capsaicin
  Capsicum tincture
   C06866  Capsaicin
 Medicinal herbs
  Cayenne papper
   C06866  Capsaicin
BRITE hierarchy
Other DBs
CAS: 
404-86-4
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8y C    14.3789  -14.5250
            2   C8x C    13.1676  -15.2238
            3   C8x C    14.3789  -13.1272
            4   C1b C    15.5904  -15.2238
            5   C8y C    11.9504  -14.5250
            6   C8x C    13.1676  -12.4226
            7   N1b N    16.8017  -14.5250
            8   C8y C    11.9504  -13.1272
            9   O2a O    10.7391  -15.2238
            10  C5a C    18.0189  -15.2179
            11  O1a O    10.7391  -12.4226
            12  C1a C     9.5219  -14.5307
            13  C1b C    19.2244  -14.5250
            14  O5a O    18.0189  -16.6216
            15  C1b C    20.4357  -15.2179
            16  C1b C    21.6529  -14.5190
            17  C1b C    22.8644  -15.2179
            18  C2b C    24.0816  -14.5190
            19  C2b C    25.2929  -15.2179
            20  C1c C    26.5042  -14.5190
            21  C1a C    27.7214  -15.2122
            22  C1a C    26.5042  -13.1156
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 2
            8     5   9 1
            9     7  10 1
            10    8  11 1
            11    9  12 1
            12   10  13 1
            13   10  14 2
            14   13  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 1
            21   20  22 1
            22    6   8 1

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