KEGG   COMPOUND: C10447Help
Entry
C10447                      Compound                               

Name
3,4-Dihydroxyphenylpropanoate;
Dihydrocaffeic acid;
3,4-Dihydroxyphenylpropionic acid;
3-(3,4-Dihydroxyphenyl)propanoate
Formula
C9H10O4
Exact mass
182.0579
Mol weight
182.1733
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Tyrosine metabolism
Enzyme
2.8.3.23        4.3.1.22
Other DBs
CAS: 
1078-61-1
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        13
            1   C8y C    27.4400  -19.5300
            2   C8x C    27.4400  -20.9300
            3   C8x C    26.1800  -18.8300
            4   C8x C    26.1800  -21.6300
            5   C8y C    24.9900  -19.5300
            6   C8y C    24.9900  -20.9300
            7   O1a O    23.7300  -21.6300
            8   O1a O    23.8000  -18.8300
            9   C1b C    28.6300  -18.8300
            10  C1b C    29.8200  -19.5300
            11  C6a C    31.0800  -18.7600
            12  O6a O    32.2700  -19.4600
            13  O6a O    31.0800  -17.4300
BOND        13
            1     1   2 1
            2     1   3 2
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     6   7 1
            7     5   6 2
            8     5   8 1
            9     1   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   11  13 2

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