KEGG   COMPOUND: C21591
Entry
C21591                      Compound                               

Name
3-O-Acetylpapaveroxine
Formula
C24H27NO8
Exact mass
457.1737
Mol weight
457.4731
Structure
Reaction
Pathway
map00950  Isoquinoline alkaloid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00946  Noscapine biosynthesis, (S)-reticuline => noscapine
Enzyme
2.1.1.352       3.1.1.105
Other DBs
PubChem: 340125651
ChEBI: 141645
KCF data

ATOM        33
            1   C1y C    18.5647  -15.4823
            2   C8y C    17.3038  -14.7817
            3   N1y N    19.7556  -14.7817
            4   C1c C    18.5647  -16.9535
            5   C8y C    17.3038  -13.3806
            6   C8y C    16.1128  -15.4823
            7   C1x C    19.7556  -13.3806
            8   C1a C    20.8064  -13.5909
            9   C8y C    19.7556  -17.5839
            10  C8x C    16.1128  -12.6801
            11  C1x C    18.4946  -12.6801
            12  C8y C    14.7817  -14.8518
            13  C8y C    20.9466  -16.8834
            14  C8x C    19.7557  -18.9850
            15  C8y C    14.7817  -13.4507
            16  O2x O    13.5207  -15.2721
            17  C8y C    22.1375  -17.5839
            18  C8x C    21.0166  -19.6856
            19  O2x O    13.4507  -13.0303
            20  C1x C    12.6801  -14.1512
            21  C8y C    22.1375  -18.9850
            22  O2a O    23.3285  -16.8834
            23  O2a O    23.3285  -19.6856
            24  C1a C    24.5194  -17.5839
            25  C1a C    24.5895  -18.9850
            26  O7a O    17.3038  -17.6540
            27  C7a C    17.3037  -19.0551
            28  C1a C    16.1829  -19.7556
            29  O6a O    18.5647  -19.7556
            30  C4a C    20.9466  -15.4823
            31  O4a O    22.0675  -14.7817
            32  O2a O    16.1128  -16.8842
            33  C1a C    14.8987  -17.5851
BOND        36
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 2
            10    5  11 1
            11    6  12 1
            12    9  14 1
            13   10  15 1
            14   12  16 1
            15   13  17 1
            16   14  18 2
            17   15  19 1
            18   16  20 1
            19   17  21 2
            20   17  22 1
            21   21  23 1
            22   22  24 1
            23   23  25 1
            24    7  11 1
            25    9  13 2
            26   12  15 2
            27   18  21 1
            28   19  20 1
            29   26  27 1
            30    4  26 1 #Down
            31   27  28 1
            32   27  29 2
            33   13  30 1
            34   30  31 2
            35    6  32 1
            36   32  33 1

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