KEGG   COMPOUND: C10428
Entry
C10428                      Compound                               
Name
Anethole;
t-Anethole;
trans-Anethole
Formula
C10H12O
Exact mass
148.0888
Mol weight
148.2017
Structure
Remark
Same as: D02377
Reaction
Pathway
map00940  Phenylpropanoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Monolignols
   Others
    C10428  Anethole
Other DBs
CAS: 4180-23-8 104-46-1
PubChem: 12613
ChEBI: 35616
KNApSAcK: C00002713 C00029334
3DMET: B03836
NIKKAJI: J4.026F
LinkDB
KCF data

ATOM        11
            1   C8y C    21.8400  -16.6484
            2   C8x C    21.8400  -18.0484
            3   C8x C    20.6383  -15.9484
            4   C2b C    23.0476  -15.9484
            5   C8x C    20.6383  -18.7542
            6   C8x C    19.4191  -16.6484
            7   C2b C    24.2608  -16.6367
            8   C8y C    19.4191  -18.0484
            9   C1a C    25.4741  -15.9424
            10  O2a O    18.2058  -18.7542
            11  C1a C    16.9866  -18.0484
BOND        11
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 2
            7     5   8 2
            8     7   9 1
            9     8  10 1
            10   10  11 1
            11    6   8 1

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