KEGG COMPOUND: C09908

COMPOUND: C09908

Entry

C09908                      Compound

Name

Thymol

Formula

C10H14O

Exact mass

150.1045

Mol weight

150.22

Structure

Remark

Same as:

D01039

Brite

Lipids [BR:br08002]
PR  Prenol lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010209 Menthane monoterpenoids
     C09908  Thymol
Phytochemical compounds [BR:br08003]
Terpenoids
  Monoterpenoids (C10)
   Cyclic monoterpenes
    C09908  Thymol
Therapeutic category of drugs in Japan [BR:br08301]
7  Agents not mainly for therapeutic purpose
  73  Public health agents
   731  Antiseptics
    7319  Others
     D01039  Thymol (JP18/NF)
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
  Inorganic and organic chemicals
   Thymol
    D01039  Thymol (JP18/NF)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
  D01039  Thymol

Other DBs

CAS:

89-83-8

PubChem:

ChEBI:

LIPIDMAPS:

KNApSAcK:

PDB-CCD:

IPB[PDBj]

NIKKAJI:

J10.606B

KCF data

ATOM        11
            1   C8y C    24.3488  -18.9804
            2   C8y C    25.5597  -18.2760
            3   C8x C    23.1320  -18.2760
            4   C1c C    24.3546  -20.3777
            5   C8x C    25.5597  -16.8728
            6   O1a O    26.7649  -18.9747
            7   C8x C    23.1320  -16.8728
            8   C1a C    23.1378  -21.0763
            9   C1a C    25.5656  -21.0704
            10  C8y C    24.3488  -16.1801
            11  C1a C    24.3546  -14.7771
BOND        11
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1
            9     5  10 1
            10   10  11 1
            11    7  10 2

» Japanese version

All links

Drug (1)   
   KEGG DRUG (1)   
Chemical substance (11)   
   PubChem (1)   
   ChEBI (2)   
   HMDB (1)   
   HSDB (1)   
   KNApSAcK (1)   
   LIPIDMAPS (1)   
   MASSBANK (2)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (12)   

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