KEGG   COMPOUND: C22038
Entry
C22038                      Compound                               
Name
(R)-3-(3,4-Dihydroxyphenyl)lactate
Formula
C9H10O5
Exact mass
198.0528
Mol weight
198.1727
Structure
Reaction
R03373 R03374 R08847 R12252
Pathway
map00350  Tyrosine metabolism
map01100  Metabolic pathways
Enzyme
1.1.1.237       2.3.1.140
Other DBs
CAS: 76822-21-4
PubChem: 384585098
PDB-CCD: TO9[PDBj]
LinkDB
KCF data

ATOM        14
            1   C8x C    15.6021  -15.4499
            2   C8y C    15.6021  -16.8483
            3   C8y C    16.8132  -17.5476
            4   C8x C    18.0244  -16.8483
            5   C8y C    18.0244  -15.4499
            6   C8x C    16.8132  -14.7506
            7   O1a O    14.3911  -17.5476
            8   O1a O    16.8132  -18.9459
            9   C1b C    19.2606  -14.7506
            10  C1c C    20.4717  -15.4499
            11  C6a C    21.6828  -14.7506
            12  O6a O    22.8939  -15.4499
            13  O1a O    20.4717  -16.8481
            14  O6a O    21.6828  -13.3522
BOND        14
            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     2   7 1
            8     3   8 1
            9     5   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   10  13 1 #Down
            14   11  14 2

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