KEGG   COMPOUND: C21875Help
Entry
C21875                      Compound                               

Name
Aurachin A
Formula
C25H33NO3
Exact mass
395.246
Mol weight
395.5344
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00998  Biosynthesis of various secondary metabolites - part 2
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00848  Aurachin biosynthesis, anthranilate => aurachin A
Other DBs
CAS: 108354-15-0
LinkDB All DBs
KCF data Show

ATOM        29
            1   C1x C    12.0400  -13.8600
            2   C8y C    12.0400  -15.2600
            3   C8y C    13.2524  -15.9600
            4   O2x O    14.4649  -15.2600
            5   C1y C    14.4649  -13.8600
            6   C8y C    10.8276  -15.9600
            7   C8y C    10.8276  -17.3600
            8   N5y N    12.0400  -18.0600 #+
            9   C8y C    13.2524  -17.3600
            10  C8x C     9.6151  -15.2600
            11  C8x C     8.4027  -15.9600
            12  C8x C     8.4027  -17.3600
            13  C8x C     9.6151  -18.0600
            14  C1d C    15.6773  -13.1600
            15  C1b C    16.8918  -13.8612
            16  C1b C    18.0824  -13.1600
            17  C2b C    19.2949  -13.8600
            18  C2c C    20.5073  -13.1600
            19  C1b C    21.7197  -13.8600
            20  C1b C    22.9322  -13.1600
            21  O1a O    14.4649  -12.4600
            22  C1a C    16.6673  -12.1701
            23  C1a C    20.5073  -11.7600
            24  C2b C    24.1653  -13.8722
            25  C2c C    25.3715  -13.1760
            26  C1a C    26.5533  -13.8585
            27  C1a C    25.3720  -11.7604
            28  O3a O    12.0400  -19.4600 #-
            29  C1a C    14.4479  -18.0504
BOND        31
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     5   4 1 #Up
            5     1   5 1
            6     2   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 2
            10    3   9 1
            11    6  10 2
            12   10  11 1
            13   11  12 2
            14   12  13 1
            15    7  13 2
            16    5  14 1
            17   14  15 1
            18   15  16 1
            19   16  17 1
            20   17  18 2
            21   18  19 1
            22   19  20 1
            23   14  21 1 #Down
            24   14  22 1
            25   18  23 1
            26   20  24 1
            27   24  25 2
            28   25  26 1
            29   25  27 1
            30    8  28 1
            31    9  29 1

» Japanese version

DBGET integrated database retrieval system