KEGG   COMPOUND: C05582Help
Entry
C05582                      Compound                               

Name
Homovanillate;
Homovanillic acid;
3-Methoxy-4-hydroxyphenylacetate
Formula
C9H10O4
Exact mass
182.0579
Mol weight
182.1733
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Tyrosine metabolism
Metabolic pathways
Dopaminergic synapse
Enzyme
1.2.1.5         2.1.1.6
Other DBs
CAS: 
306-08-1
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        13
            1   C8x C    12.9500   -6.6500
            2   C8y C    12.9500   -8.0500
            3   C8y C    14.1624   -8.7500
            4   C8x C    15.3749   -8.0500
            5   C8y C    15.3749   -6.6500
            6   C8x C    14.1624   -5.9500
            7   C1b C    16.6124   -5.9500
            8   C6a C    17.8249   -6.6500
            9   O6a O    19.0560   -5.9390
            10  O6a O    17.8250   -8.0498
            11  O2a O    14.1624  -10.1498
            12  O1a O    11.7376   -8.7500
            13  C1a C    12.9332  -10.8597
BOND        13
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 2
            10    8  10 1
            11    3  11 1
            12    2  12 1
            13   11  13 1

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