KEGG   COMPOUND: C05442Help
Entry
C05442                      Compound                               

Name
Stigmasterol
Formula
C29H48O
Exact mass
412.3705
Mol weight
412.6908
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid biosynthesis
Biosynthesis of plant secondary metabolites
Biosynthesis of terpenoids and steroids
Biosynthesis of secondary metabolites
Enzyme
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  29-Carbon atoms
   Stigmastane derivatives
    C05442  Stigmasterol
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST01 Sterols
   ST0104 Stigmasterols and C24-ethyl derivatives
    C05442  Stigmasterol
Phytochemical compounds [BR:br08003]
 Terpenoids
  Steroids
   Stigmastane
    C05442  Stigmasterol
Major components of natural products [BR:br08323]
 Medicinal herbs
  Pumpkin seed
   C05442  Stigmasterol
BRITE hierarchy
Other DBs
CAS: 
83-48-7
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        30
            1   C1y C    26.3890  -22.3751
            2   C1y C    25.2471  -23.0284
            3   C1z C    26.3826  -21.0493
            4   C1x C    28.6918  -22.4195
            5   C1y C    24.0798  -22.3877
            6   C1x C    25.2533  -24.3670
            7   C1y C    27.5310  -20.3703
            8   C1x C    25.2344  -20.3831
            9   C1a C    26.3953  -19.4948
            10  C1x C    28.6918  -21.0301
            11  C1z C    22.9443  -23.0411
            12  C1x C    24.1052  -20.9160
            13  C2x C    24.0990  -25.0394
            14  C1c C    27.5245  -18.9874
            15  C2y C    22.9506  -24.3797
            16  C1x C    21.7833  -22.4006
            17  C1a C    22.9760  -21.4107
            18  C2b C    28.7172  -18.2896
            19  C1a C    26.4015  -18.1628
            20  C1x C    21.8024  -25.0521
            21  C1x C    20.6414  -23.0602
            22  C2b C    29.9162  -18.9747
            23  C1y C    20.6540  -24.3861
            24  C1c C    31.1089  -18.2768
            25  O1a O    19.4550  -25.0775
            26  C1c C    32.3270  -18.9874
            27  C1a C    33.5195  -18.2960
            28  C1a C    32.3332  -20.5795
            29  C1b C    31.1080  -16.8784
            30  C1a C    29.8841  -16.1728
BOND        33
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     3   9 1 #Up
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    7  14 1
            14   11  15 1
            15   11  16 1
            16   11  17 1 #Up
            17   14  18 1
            18   14  19 1 #Down
            19   15  20 1
            20   16  21 1
            21   18  22 2
            22   20  23 1
            23   22  24 1
            24   23  25 1 #Up
            25   24  26 1
            26   26  27 1
            27   26  28 1
            28    7  10 1
            29    8  12 1
            30   13  15 2
            31   21  23 1
            32   24  29 1 #Up
            33   29  30 1

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