KEGG   COMPOUND: C01943Help
Entry
C01943                      Compound                               

Name
Obtusifoliol;
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol;
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol
Formula
C30H50O
Exact mass
426.3862
Mol weight
426.7174
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00100  Steroid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.14.13.70      5.5.1.9
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C01943  Obtusifoliol
BRITE hierarchy
Other DBs
CAS: 16910-32-0
PubChem: 5047
ChEBI: 17791
ChEMBL: CHEMBL1978954 CHEMBL481434
LIPIDMAPS: LMST01010124
LipidBank: SST9079
KNApSAcK: C00007368
3DMET: B01520
NIKKAJI: J69.979I
KCF data Show

ATOM        31
            1   C1z C    16.5513  -15.1649
            2   C2y C    15.2457  -15.8344
            3   C1z C    16.5047  -13.8825
            4   C1x C    18.9301  -15.2117
            5   C1a C    16.5279  -16.7564
            6   C2y C    14.1140  -15.2408
            7   C1x C    15.2282  -17.3038
            8   C1y C    17.7006  -13.2114
            9   C1x C    15.3216  -13.1820
            10  C1a C    16.4930  -12.4994
            11  C1x C    18.8777  -13.9045
            12  C1z C    12.9194  -15.9163
            13  C1x C    14.1257  -13.8649
            14  C1x C    14.1723  -17.9924
            15  C1c C    17.7181  -11.8354
            16  C1y C    12.9835  -17.2980
            17  C1x C    11.7306  -15.2349
            18  C1a C    12.9777  -14.5404
            19  C1b C    18.9186  -11.1587
            20  C1a C    16.5338  -11.1294
            21  C1y C    11.7306  -17.9866
            22  C1x C    10.5349  -15.9163
            23  C1b C    20.1084  -11.8648
            24  C1y C    10.5349  -17.2980
            25  C1a C    11.7366  -19.4383
            26  C2c C    21.3031  -11.1879
            27  O1a O     9.3461  -17.9866
            28  C1c C    22.4931  -11.8939
            29  C2a C    21.2506   -9.9462
            30  C1a C    23.6936  -11.2172
            31  C1a C    22.4756  -13.4099
BOND        34
            1     1   3 1
            2     1   4 1
            3     1   5 1 #Down
            4     2   6 2
            5     2   7 1
            6     3   8 1
            7     3   9 1
            8     3  10 1 #Up
            9     4  11 1
            10    6  12 1
            11    6  13 1
            12    7  14 1
            13    8  15 1
            14   12  16 1
            15   12  17 1
            16   12  18 1 #Up
            17   15  19 1
            18   15  20 1 #Down
            19   16  21 1
            20   17  22 1
            21   19  23 1
            22   21  24 1
            23   21  25 1 #Down
            24   23  26 1
            25   24  27 1 #Up
            26   26  28 1
            27   26  29 2
            28   28  30 1
            29   28  31 1
            30    8  11 1
            31    9  13 1
            32   14  16 1
            33   22  24 1
            34    1   2 1

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