KEGG   COMPOUND: C01468Help
Entry
C01468                      Compound                               

Name
4-Cresol;
p-Cresol;
4-Hydroxytoluene;
4-Methylphenol
Formula
C7H8O
Exact mass
108.0575
Mol weight
108.1378
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00623  Toluene degradation
map00633  Nitrotoluene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
map04974  Protein digestion and absorption
Enzyme
1.14.13.7       1.14.13.236     1.14.13.-       1.14.15.-       
1.17.9.1        4.1.1.83        4.1.99.19
Other DBs
CAS: 106-44-5
PubChem: 4643
ChEBI: 17847
ChEMBL: CHEMBL16645
KNApSAcK: C00002645
PDB-CCD: PCR[PDBj]
3DMET: B00295
NIKKAJI: J1.185A
LinkDB All DBs
KCF data Show

ATOM        8
            1   C8y C    25.6900  -20.4533
            2   C8x C    24.4815  -19.7371
            3   C8x C    26.9050  -19.7371
            4   C1a C    25.6837  -21.8407
            5   C8x C    24.4815  -18.3301
            6   C8x C    26.9050  -18.3301
            7   C8y C    25.6900  -17.6395
            8   O1a O    25.6837  -16.2456
BOND        8
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     7   8 1
            8     6   7 2

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