KEGG   COMPOUND: C22449
Entry
C22449                      Compound                               
Name
Paerucumarin
Formula
C10H5NO4
Exact mass
203.0219
Mol weight
203.151
Structure
Reaction
R12884
Pathway
map00997  Biosynthesis of various other secondary metabolites
Brite
Secondary metabolites in pathway maps [br08011.html]
 Biosynthetic pathways and modules of secondary metabolites
  C22449
LinkDB
KCF data

ATOM        15
            1   C8y C     9.3480  -12.2180
            2   C8y C     9.3480  -13.5216
            3   C8x C    10.5144  -14.2076
            4   C8y C    11.6806  -13.5216
            5   C8y C    11.6806  -12.2180
            6   C8x C    10.5144  -11.5320
            7   O1a O     8.1818  -14.2076
            8   C8y C    14.0133  -12.2180
            9   C8x C    12.8470  -11.5320
            10  C8y C    14.0133  -13.5926
            11  N3a N    15.2038  -11.5307 #+
            12  O6a O    15.2038  -14.2799
            13  O7x O    12.8228  -14.2799
            14  C3a C    16.9440  -10.4998 #-
            15  O1a O     8.1705  -11.5449
BOND        16
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1
            8     8   9 2
            9     5   9 1
            10    8  10 1
            11    8  11 1
            12   10  12 2
            13   10  13 1
            14   11  14 3
            15   13   4 1
            16    1  15 1

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