KEGG   COMPOUND: C15802
Entry
C15802                      Compound                               

Name
6-Deoxocastasterone
Formula
C28H50O4
Exact mass
450.3709
Mol weight
450.6942
Structure
Reaction
Pathway
map00905  Brassinosteroid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00371  Castasterone biosynthesis, campesterol => castasterone
Enzyme
1.14.-.-
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C15802  6-Deoxocastasterone
Other DBs
PubChem: 47205127
ChEBI: 20712
NIKKAJI: J146.605D
KCF data

ATOM        32
            1   C1y C    25.8973  -23.2982
            2   C1y C    25.8973  -24.6712
            3   C1x C    27.0861  -25.3576
            4   C1y C    28.2752  -24.6712
            5   C1z C    28.2752  -23.2982
            6   C1x C    27.0861  -22.6115
            7   C1x C    29.4642  -25.3576
            8   C1x C    30.6529  -24.6712
            9   C1y C    30.6529  -23.2982
            10  C1y C    29.4642  -22.6115
            11  C1y C    31.8421  -22.6115
            12  C1z C    31.8421  -21.2388
            13  C1x C    30.6529  -20.5524
            14  C1x C    29.4642  -21.2388
            15  C1x C    34.2201  -22.6115
            16  C1x C    34.2201  -21.2388
            17  C1y C    33.0311  -20.5524
            18  C1c C    33.0311  -19.1794
            19  C1c C    34.2240  -18.4907
            20  C1c C    35.3983  -19.1689
            21  C1c C    36.5616  -18.4971
            22  C1c C    37.7304  -19.1723
            23  C1a C    37.7304  -20.5521
            24  C1a C    28.2752  -21.9251
            25  C1a C    31.8421  -19.8663
            26  C1a C    31.8421  -18.4929
            27  C1a C    38.9193  -18.4857
            28  O1a O    34.2241  -17.0879
            29  O1a O    35.3980  -20.5841
            30  O1a O    24.7027  -25.3606
            31  O1a O    24.7046  -22.6100
            32  C1a C    36.5616  -17.0971
BOND        35
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   15  16 1
            18   16  17 1
            19   12  17 1
            20   11  15 1
            21   17  18 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   22  23 1
            27    5  24 1 #Up
            28   12  25 1 #Up
            29   18  26 1 #Down
            30   22  27 1
            31   19  28 1 #Up
            32   20  29 1 #Up
            33    2  30 1 #Down
            34    1  31 1 #Down
            35   21  32 1 #Up

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