KEGG   COMPOUND: C21954Help
Entry
C21954                      Compound                               

Name
(+)-Piperitol
Formula
C20H20O6
Exact mass
356.126
Mol weight
356.3692
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00999  Biosynthesis of secondary metabolites - unclassified
map01110  Biosynthesis of secondary metabolites
Enzyme
Other DBs
PubChem: 376218987
ChEMBL: CHEMBL1688935 CHEMBL1688938
KCF data Show

ATOM        26
            1   C8x C    35.8490  -12.7455
            2   C8y C    35.8490  -14.1461
            3   C8x C    37.0395  -14.8464
            4   C8x C    37.0395  -12.0452
            5   C8y C    38.2300  -12.7455
            6   C8y C    38.2300  -14.1461
            7   C1y C    34.6585  -14.8464
            8   O2x O    33.5380  -14.0760
            9   C1x C    32.3475  -14.8464
            10  C1y C    34.2383  -16.1769
            11  C1y C    32.8377  -16.1769
            12  C1y C    32.3475  -17.5075
            13  O2x O    33.5380  -18.3479
            14  C1x C    34.6585  -17.5075
            15  C8y C    31.0870  -18.2778
            16  C8x C    29.8965  -20.3787
            17  C8x C    31.0870  -19.6784
            18  C8x C    29.8965  -17.5775
            19  C8y C    28.6359  -19.6784
            20  C8y C    28.6359  -18.2778
            21  O2x O    27.3053  -17.8577
            22  C1x C    26.5350  -18.9781
            23  O2x O    27.3053  -20.0986
            24  O2a O    39.4425  -14.8461
            25  C1a C    40.6549  -14.1461
            26  O1a O    39.4425  -12.0455
BOND        30
            1     5   6 2
            2    10  11 1
            3    11  12 1
            4    12  13 1
            5    13  14 1
            6    14  10 1
            7    12  15 1 #Down
            8     4   1 2
            9    19  16 1
            10   16  17 2
            11   17  15 1
            12   15  18 2
            13   18  20 1
            14    1   2 1
            15   10   7 1
            16    7   8 1
            17    8   9 1
            18   19  20 2
            19   20  21 1
            20   21  22 1
            21   22  23 1
            22   23  19 1
            23    7   2 1 #Down
            24    9  11 1
            25    2   3 2
            26    3   6 1
            27    5   4 1
            28    6  24 1
            29   24  25 1
            30    5  26 1

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