KEGG   COMPOUND: C05849
Entry
C05849                      Compound                               
Name
Vitamin K1 epoxide;
(2,3-Epoxyphytyl)menaquinone;
2,3-Epoxy-2,3-dihydro-2-methyl-3-phytyl-1,4-naphthoquinone;
2,3-Epoxyphylloquinone;
1a,7a-Dihydro-1a-methyl-7a-(3,7,11,15-tetramethyl-2-hexadecenyl)-naphth[2,3-b]oxirene-2,7-dione;
Phylloquinone oxide;
Phylloquinone epoxide;
Phylloquinone-2,3-epoxide;
Vitamin K1 2,3-epoxide;
Vitamin K1 oxide
Formula
C31H46O3
Exact mass
466.3447
Mol weight
466.6951
Structure
Reaction
R03510 R03511 R03512 R05144 R05830
Pathway
map00130  Ubiquinone and other terpenoid-quinone biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01240  Biosynthesis of cofactors
Enzyme
1.14.99.20      1.17.4.4        1.17.4.5        4.1.1.90
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR02 Quinones and hydroquinones
   PR0203 Vitamin K
    C05849  Vitamin K epoxide
Other DBs
CAS: 25486-55-9
PubChem: 8142
ChEBI: 28371
LIPIDMAPS: LMPR02030031
3DMET: B05123
NIKKAJI: J16.897A
LinkDB
KCF data

ATOM        34
            1   C1z C    18.4069  -15.1654
            2   C1z C    18.3933  -16.5579
            3   O2x O    19.6159  -15.8651
            4   C5x C    17.2045  -14.4524
            5   C1b C    19.6159  -14.4455
            6   C5x C    17.1842  -17.2440
            7   C1a C    19.6024  -17.2643
            8   C8y C    15.9888  -15.1451
            9   O5x O    17.1909  -13.0463
            10  C2b C    20.8181  -15.1518
            11  C8y C    15.9752  -16.5376
            12  O5x O    17.1706  -18.6500
            13  C8x C    14.7797  -14.4319
            14  C2c C    22.0339  -14.4388
            15  C8x C    14.7661  -17.2371
            16  C8x C    13.5570  -15.1315
            17  C1b C    23.2362  -15.1451
            18  C1a C    22.0272  -13.0394
            19  C8x C    13.5501  -16.5307
            20  C1b C    24.4453  -14.4319
            21  C1b C    25.6544  -15.1382
            22  C1c C    26.8634  -14.4252
            23  C1b C    28.0656  -15.1315
            24  C1a C    26.8498  -13.0258
            25  C1b C    29.2747  -14.4183
            26  C1b C    30.4837  -15.1180
            27  C1c C    31.6859  -14.4116
            28  C1b C    32.9019  -15.1111
            29  C1a C    31.6792  -13.0122
            30  C1b C    34.1040  -14.4047
            31  C1b C    35.3131  -15.1044
            32  C1c C    36.5222  -14.3980
            33  C1a C    37.7312  -15.0975
            34  C1a C    36.5155  -12.9920
BOND        36
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     4   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 1
            11    6  12 2
            12    8  13 2
            13   10  14 2
            14   11  15 2
            15   13  16 1
            16   14  17 1
            17   14  18 1
            18   15  19 1
            19   17  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   22  24 1
            24   23  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   27  29 1
            29   28  30 1
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   32  34 1
            34    2   3 1
            35    8  11 1
            36   16  19 2

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