KEGG   COMPOUND: C16257
Entry
C16257                      Compound                               

Name
(R)-Phenyllactyl-CoA;
(R)-3-(Phenyl)lactoyl-CoA
Formula
C30H44N7O18P3S
Exact mass
915.1676
Mol weight
915.6927
Structure
Reaction
Pathway
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
Enzyme
2.3.1.-         2.8.3.17        4.2.1.175
Other DBs
PubChem: 47205565
ChEBI: 11010
NIKKAJI: J2.799.274I
KCF data

ATOM        59
            1   C1c C    11.9000  -20.7200
            2   C1b C    10.7100  -20.0200
            3   C8y C     9.5200  -20.7200
            4   O1a O    11.9000  -22.1200
            5   C8x C     9.5200  -22.1200
            6   C8x C     8.2600  -22.8200
            7   C8x C     7.0700  -22.1200
            8   C8x C     7.0700  -20.7200
            9   C8x C     8.2600  -20.0200
            10  C5a C    13.1600  -20.0200
            11  S2a S    14.3500  -20.7200
            12  C1b C    15.5400  -20.0200
            13  C1b C    16.8000  -20.7200
            14  N1b N    17.9900  -20.0200
            15  C5a C    19.1800  -20.7200
            16  C1b C    20.4400  -20.0200
            17  C1b C    21.6300  -20.7200
            18  N1b N    22.8200  -20.0200
            19  C5a C    24.0800  -20.7200
            20  C1c C    25.2700  -20.0200
            21  C1d C    26.4600  -20.7200
            22  C1b C    27.6500  -20.0200
            23  O2b O    28.9100  -20.7200
            24  O5a O    13.1600  -18.6200
            25  O5a O    19.1800  -22.1200
            26  O5a O    24.0800  -22.1200
            27  O1a O    25.2700  -18.6200
            28  C1a C    26.4600  -19.3200
            29  C1a C    26.4600  -22.1200
            30  P1b P    30.3100  -20.7200
            31  O1c O    31.7100  -20.7200
            32  O1c O    30.3100  -22.1200
            33  C1y C    23.8000  -15.7500
            34  C1y C    25.2000  -15.7500
            35  C1y C    25.6200  -14.4200
            36  O2x O    24.5000  -13.5800
            37  C1y C    23.3800  -14.4200
            38  C1b C    26.9500  -14.0000
            39  O1a O    22.9600  -16.8700
            40  O2b O    26.0400  -16.8700
            41  P1b P    27.4400  -16.8700
            42  O1c O    27.4400  -15.4700
            43  O1c O    28.8400  -16.8700
            44  O1c O    27.4400  -18.2700
            45  C8y C    19.2500  -12.6000
            46  C8y C    19.2500  -14.0000
            47  N4y N    21.7000  -14.0000
            48  C8x C    21.7000  -12.6000
            49  N5x N    20.4400  -11.9000
            50  C8y C    18.0600  -11.9000
            51  N5x N    16.8000  -12.6000
            52  C8x C    16.8000  -14.0000
            53  N5x N    18.0600  -14.7000
            54  N1a N    18.0600  -10.5000
            55  O2b O    28.9100  -14.4200
            56  P1b P    30.3100  -14.4200
            57  O1c O    30.3100  -13.0200
            58  O1c O    31.7100  -14.4200
            59  O2c O    30.3100  -17.6400
BOND        62
            1     1   2 1
            2     2   3 1
            3     1   4 1 #Down
            4     3   5 2
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 2
            9     3   9 1
            10    1  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   10  24 2
            25   15  25 2
            26   19  26 2
            27   20  27 1 #Down
            28   21  28 1
            29   21  29 1
            30   23  30 1
            31   30  31 2
            32   30  32 1
            33   33  34 1
            34   34  35 1
            35   35  36 1
            36   36  37 1
            37   33  37 1
            38   35  38 1 #Down
            39   33  39 1 #Up
            40   34  40 1 #Up
            41   40  41 1
            42   41  42 1
            43   41  43 1
            44   41  44 2
            45   45  46 2
            46   46  47 1
            47   47  48 1
            48   48  49 2
            49   45  49 1
            50   45  50 1
            51   50  51 2
            52   51  52 1
            53   52  53 2
            54   46  53 1
            55   50  54 1
            56   37  47 1 #Down
            57   38  55 1
            58   55  56 1
            59   56  57 1
            60   56  58 2
            61   56  59 1
            62   30  59 1

» Japanese version

DBGET integrated database retrieval system