KEGG   COMPOUND: C06071
Entry
C06071                      Compound                               
Name
Deoxyloganin;
7-Deoxyloganin
Formula
C17H26O9
Exact mass
374.1577
Mol weight
374.3829
Structure
Reaction
Pathway
map00902  Monoterpenoid biosynthesis
map01062  Biosynthesis of terpenoids and steroids
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.14.85      2.4.1.324
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010207 Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids
     C06071  Deoxyloganin
Phytochemical compounds [BR:br08003]
 Terpenoids
  Monoterpenoids (C10)
   Iridoids
    C06071  Deoxyloganin
Other DBs
CAS: 26660-57-1
PubChem: 8338
ChEBI: 18370
LIPIDMAPS: LMPR0102070005
KNApSAcK: C00003077
3DMET: B01963
NIKKAJI: J17.142E
KCF data

ATOM        26
            1   C1y C    25.4589  -14.7252
            2   C1y C    25.4589  -13.3446
            3   C1y C    26.6388  -15.4270
            4   C1y C    24.1437  -15.1496
            5   C2y C    26.6388  -12.6661
            6   C1x C    24.1496  -12.9319
            7   O2a O    26.6214  -17.4921
            8   O2x O    27.8364  -14.7252
            9   C1x C    23.3472  -14.0292
            10  C1a C    23.7192  -16.4415
            11  C2x C    27.8364  -13.3446
            12  C7a C    26.7030  -11.2971
            13  C1y C    25.3587  -18.5415
            14  O7a O    27.8188  -10.6254
            15  O6a O    25.4472  -10.6313
            16  O2x O    24.1670  -17.8629
            17  C1y C    25.3587  -19.9103
            18  C1a C    28.9989  -11.2971
            19  C1y C    22.9939  -18.5474
            20  C1y C    24.1670  -20.5949
            21  O1a O    26.5445  -20.5949
            22  C1y C    22.9939  -19.9103
            23  C1b C    21.8197  -17.8629
            24  O1a O    24.1670  -21.9510
            25  O1a O    21.8197  -20.5949
            26  O1a O    20.7750  -18.7421
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1 #Up
            7     3   8 1
            8     4   9 1
            9     4  10 1 #Up
            10    5  11 2
            11    5  12 1
            12   13   7 1 #Up
            13   12  14 1
            14   12  15 2
            15   13  16 1
            16   13  17 1
            17   14  18 1
            18   16  19 1
            19   17  20 1
            20   17  21 1 #Down
            21   19  22 1
            22   19  23 1 #Up
            23   20  24 1 #Up
            24   22  25 1 #Down
            25   23  26 1
            26    6   9 1
            27    8  11 1
            28   20  22 1

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