KEGG   COMPOUND: C22014
Entry
C22014                      Compound                               
Name
7-Deoxyloganetic alcohol
Formula
C10H16O3
Exact mass
184.1099
Mol weight
184.2322
Structure
Reaction
R12231 R12253
Pathway
map00902  Monoterpenoid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.161
Other DBs
PubChem: 384585074
LinkDB
KCF data

ATOM        13
            1   O1a O    19.7204  -19.0184
            2   C1y C    18.4572  -16.9131
            3   C1y C    18.4572  -15.5095
            4   C1y C    19.7204  -17.6148
            5   C1y C    17.1238  -17.3341
            6   C2y C    19.7204  -14.8077
            7   C1x C    17.1238  -15.0884
            8   O2x O    20.9134  -16.9131
            9   C1x C    16.3518  -16.2113
            10  C2x C    20.9134  -15.5095
            11  C1b C    19.7204  -13.4041
            12  C1a C    16.7027  -18.6675
            13  O1a O    20.9328  -12.7041
BOND        14
            1     2   3 1
            2     2   4 1
            3     2   5 1
            4     3   6 1
            5     3   7 1
            6     4   8 1
            7     5   9 1
            8     6  10 2
            9     6  11 1
            10    7   9 1
            11    8  10 1
            12    4   1 1 #Up
            13    5  12 1 #Up
            14   11  13 1

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