KEGG   COMPOUND: C22935
Entry
C22935                      Compound                               
Name
Dihydroprecondylocarpine acetate
Formula
C23H29N2O4
Exact mass
397.2127
Mol weight
397.49
Structure
Reaction
R13345 R13376
Pathway
map00901  Indole alkaloid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00965  Vinblastine biosynthesis, geissoschizine => vinblastine
Enzyme
1.3.1.128
Other DBs
PubChem: 497620286
LinkDB
KCF data

ATOM        29
            1   C8y C    16.6600  -15.2600
            2   C8y C    16.6600  -16.5900
            3   C8x C    14.3500  -15.3300
            4   C8x C    14.3500  -16.6600
            5   C8x C    15.5400  -17.2900
            6   C8x C    15.4700  -14.6300
            7   C1z C    19.9500  -15.7500
            8   C1y C    20.5100  -14.5600
            9   C1x C    19.7400  -13.5100
            10  C1x C    18.4100  -13.6500
            11  N2y N    17.4300  -12.7400 #+
            12  C1x C    16.3100  -13.4400
            13  C1x C    16.5900  -14.7000
            14  C2x C    18.9000  -11.6900
            15  C1y C    21.3500  -13.5100
            16  C7a C    20.7900  -16.8700
            17  O7a O    22.0500  -16.6600
            18  O6a O    20.3700  -18.0600
            19  C1a C    22.8900  -17.7800
            20  C8y C    18.6900  -15.9600
            21  C8y C    17.8500  -14.8400
            22  C1b C    22.5400  -14.2100
            23  C1a C    22.5400  -15.6100
            24  N4x N    17.9900  -16.8700
            25  C1b C    19.3200  -16.9400
            26  O7a O    19.3200  -18.2000
            27  C7a C    19.3200  -19.6000
            28  C1a C    18.1300  -20.3000
            29  O6a O    20.5100  -20.3000
BOND        32
            1    12  13 1
            2    21  13 1
            3    11  14 2
            4     1   2 2
            5     8  15 1
            6    14  15 1
            7     3   4 1
            8     7  16 1
            9    20   7 1
            10   16  17 1
            11    7   8 1
            12   16  18 2
            13    8   9 1
            14   17  19 1
            15    9  10 1
            16    4   5 2
            17    5   2 1
            18   20  21 2
            19   21   1 1
            20    2  24 1
            21   24  20 1
            22    1   6 1
            23   15  22 1
            24    6   3 2
            25   22  23 1
            26   10  11 1
            27    7  25 1 #Up
            28   11  12 1
            29   25  26 1
            30   26  27 1
            31   27  28 1
            32   27  29 2

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