KEGG   COMPOUND: C15792Help
Entry
C15792                      Compound                               

Name
3-Dehydroteasterone
Formula
C28H46O4
Exact mass
446.3396
Mol weight
446.6624
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00905  Brassinosteroid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.-.-
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C15792  3-Dehydroteasterone
BRITE hierarchy
Other DBs
PubChem: 47205117
ChEBI: 20000
NIKKAJI: J590.103K
LinkDB All DBs
KCF data Show

ATOM        32
            1   C1x C    25.8692  -22.9193
            2   C5x C    25.8692  -24.2909
            3   C1x C    27.0571  -24.9765
            4   C1y C    28.2450  -24.2909
            5   C1z C    28.2450  -22.9193
            6   C1x C    27.0571  -22.2336
            7   C5x C    29.4326  -24.9765
            8   C1x C    30.6202  -24.2909
            9   C1y C    30.6202  -22.9193
            10  C1y C    29.4326  -22.2336
            11  C1y C    31.8082  -22.2336
            12  C1z C    31.8082  -20.8621
            13  C1x C    30.6202  -20.1761
            14  C1x C    29.4326  -20.8621
            15  C1x C    34.1838  -22.2336
            16  C1x C    34.1838  -20.8621
            17  C1y C    32.9959  -20.1761
            18  C1c C    32.9959  -18.8049
            19  C1c C    34.1877  -18.1170
            20  C1c C    35.3606  -18.7944
            21  C1c C    36.5228  -18.1234
            22  C1c C    37.6903  -18.7978
            23  C1a C    37.6903  -20.1758
            24  C1a C    28.2450  -21.5477
            25  C1a C    31.8082  -19.4910
            26  C1a C    31.8082  -18.1192
            27  C1a C    38.8779  -18.1119
            28  O5x O    29.4330  -26.3969
            29  O1a O    34.1879  -16.7074
            30  O1a O    35.3610  -20.2206
            31  O5x O    24.6813  -24.9773
            32  C1a C    36.5228  -16.7234
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    7  28 2
            32   19  29 1 #Up
            33   20  30 1 #Up
            34    2  31 2
            35   21  32 1 #Up

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