KEGG   COMPOUND: C16666
Entry
C16666                      Compound                               
Name
Vanillylamine
Formula
C8H11NO2
Exact mass
153.079
Mol weight
153.1784
Structure
Reaction
Pathway
map00996  Biosynthesis of various alkaloids
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
2.3.2.35        2.6.1.119
Other DBs
CAS: 1196-92-5
PubChem: 51090990
ChEBI: 46958
NIKKAJI: J60.119E
KCF data

ATOM        11
            1   C8y C    14.5600  -15.1200
            2   C8y C    14.5600  -16.5200
            3   C8x C    15.7724  -17.2200
            4   C8x C    16.9849  -16.5200
            5   C8y C    16.9849  -15.1200
            6   C8x C    15.7724  -14.4200
            7   O2a O    13.3476  -14.4200
            8   C1a C    12.1521  -15.1104
            9   O1a O    13.3476  -17.2200
            10  C1b C    18.2160  -14.4090
            11  N1a N    19.4212  -15.1047
BOND        11
            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     1   7 1
            8     7   8 1
            9     2   9 1
            10    5  10 1
            11   10  11 1

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