KEGG   COMPOUND: C06578
Entry
C06578                      Compound                               
Name
p-Cumate
Formula
C10H12O2
Exact mass
164.0837
Mol weight
164.2011
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
M00539  Cumate degradation, p-cumate => 2-oxopent-4-enoate + 2-methylpropanoate
Enzyme
1.2.1.29        1.14.12.25
Other DBs
CAS: 536-66-3
PubChem: 8807
ChEBI: 25822 28122
KNApSAcK: C00036581
PDB-CCD: 4IA[PDBj]
3DMET: B00978
NIKKAJI: J6.354A
LinkDB
KCF data

ATOM        12
            1   C8y C    28.8400  -18.3381
            2   C1c C    28.8400  -19.7421
            3   C8x C    27.6233  -17.6420
            4   C8x C    30.0450  -17.6420
            5   C1a C    27.6291  -20.4383
            6   C1a C    30.0567  -20.4383
            7   C8x C    27.6233  -16.2380
            8   C8x C    30.0450  -16.2380
            9   C8y C    28.8400  -15.5419
            10  C6a C    28.8400  -14.1379
            11  O6a O    30.0567  -13.4417
            12  O6a O    27.6291  -13.4417
BOND        12
            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   10  11 1
            11   10  12 2
            12    8   9 2

» Japanese version

DBGET integrated database retrieval system