KEGG   COMPOUND: C15797Help
Entry
C15797                      Compound                               

Name
22alpha-Hydroxy-5alpha-campestan-3-one;
(22S,24R)-22-Hydroxy-5alpha-ergostan-3-one
Formula
C28H48O2
Exact mass
416.3654
Mol weight
416.6795
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00905  Brassinosteroid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00371  Castasterone biosynthesis, campesterol => castasterone
Enzyme
1.3.1.22        1.14.13.-       1.14.14.147
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C15797  22alpha-Hydroxy-5alpha-campestan-3-one
BRITE hierarchy
Other DBs
PubChem: 47205122
ChEBI: 59411
NIKKAJI: J1.831.610B
KCF data Show

ATOM        30
            1   C1x C    25.8927  -23.2934
            2   C5x C    25.8927  -24.6661
            3   C1x C    27.0814  -25.3525
            4   C1y C    28.2704  -24.6661
            5   C1z C    28.2704  -23.2934
            6   C1x C    27.0814  -22.6069
            7   C1x C    29.4591  -25.3525
            8   C1x C    30.6476  -24.6661
            9   C1y C    30.6476  -23.2934
            10  C1y C    29.4591  -22.6069
            11  C1y C    31.8365  -22.6069
            12  C1z C    31.8365  -21.2344
            13  C1x C    30.6476  -20.5481
            14  C1x C    29.4591  -21.2344
            15  C1x C    34.2142  -22.6069
            16  C1x C    34.2142  -21.2344
            17  C1y C    33.0253  -20.5481
            18  C1c C    33.0253  -19.1754
            19  C1c C    34.2181  -18.4868
            20  C1b C    35.3921  -19.1649
            21  C1c C    36.5552  -18.4932
            22  C1c C    37.7238  -19.1683
            23  C1a C    37.7238  -20.5478
            24  C1a C    28.2704  -21.9206
            25  C1a C    31.8365  -19.8621
            26  C1a C    31.8365  -18.4890
            27  C1a C    38.9124  -18.4818
            28  O1a O    34.2182  -17.0842
            29  O5x O    24.6969  -25.3563
            30  C1a C    36.5552  -17.0932
BOND        33
            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    2  29 2
            33   21  30 1 #Up

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