KEGG   COMPOUND: C14045
Entry
C14045                      Compound                               

Name
C25-Epoxy-apo-aldehyde;
(3S,5R,6S)-5,6-Epoxy-3-hydroxy-5,6-dihydro-12'-apo-beta-caroten-12'-al
Formula
C25H34O3
Exact mass
382.2508
Mol weight
382.5357
Structure
Reaction
Enzyme
Other DBs
PubChem: 854283
ChEBI: 34597
LIPIDMAPS: LMPR01070294
NIKKAJI: J39.349E
KCF data

ATOM        28
            1   C4a C    23.6566  -10.8287
            2   C2c C    23.6565  -12.2288
            3   C2b C    24.8687  -12.9288
            4   C2b C    24.8686  -14.3288
            5   C2b C    26.0809  -15.0289
            6   C2b C    26.0807  -16.4289
            7   C2c C    27.2932  -17.1290
            8   C2b C    27.2930  -18.5290
            9   C2b C    28.5053  -19.2291
            10  C2b C    28.5052  -20.6289
            11  C2c C    29.7175  -21.3291
            12  C2b C    29.7199  -22.7216
            13  C2b C    30.9328  -23.4213
            14  C1z C    30.9298  -24.8164
            15  C1z C    29.6464  -25.5836
            16  C1x C    29.7133  -26.9128
            17  C1y C    30.9235  -27.6151
            18  C1x C    32.1372  -26.9179
            19  C1z C    32.1402  -25.5187
            20  C1a C    22.4448  -12.9281
            21  C1a C    28.5075  -16.4281
            22  C1a C    30.9329  -20.6260
            23  O1a O    30.9206  -29.0111
            24  C1a C    28.5024  -26.2126
            25  O2x O    29.7151  -24.1136
            26  C1a C    32.5176  -24.1655
            27  C1a C    33.5440  -25.5186
            28  O4a O    22.4437  -10.1252
BOND        29
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   14  19 1
            20    2  20 1
            21    7  21 1
            22   11  22 1
            23   17  23 1 #Down
            24   15  24 1 #Down
            25   15  25 1 #Up
            26   14  25 1 #Up
            27   19  26 1 #Down
            28   19  27 1 #Up
            29    1  28 2

» Japanese version

DBGET integrated database retrieval system