KEGG   COMPOUND: C06575
Entry
C06575                      Compound                               
Name
p-Cymene
Formula
C10H14
Exact mass
134.1096
Mol weight
134.2182
Structure
Reaction
Pathway
map00622  Xylene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Module
M00419  Cymene degradation, p-cymene => p-cumate
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010209 Menthane monoterpenoids
     C06575  p-Cymene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Monoterpenoids (C10)
   Cyclic monoterpenes
    C06575  p-Cymene
Other DBs
CAS: 99-87-6
PubChem: 8804
ChEBI: 28768
LIPIDMAPS: LMPR0102090014
KNApSAcK: C00003040
PDB-CCD: MML[PDBj]
3DMET: B00975
NIKKAJI: J11.621A
KCF data

ATOM        10
            1   C8y C    28.8400  -17.9940
            2   C1c C    28.8400  -19.3906
            3   C8x C    27.6238  -17.2900
            4   C8x C    30.0503  -17.2900
            5   C1a C    27.6297  -20.0889
            6   C1a C    30.0562  -20.0832
            7   C8x C    27.6238  -15.8877
            8   C8x C    30.0503  -15.8877
            9   C8y C    28.8400  -15.1951
            10  C1a C    28.8400  -13.7927
BOND        10
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     7   9 1
            9     9  10 1
            10    8   9 2

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