KEGG   COMPOUND: C21631Help
Entry
C21631                      Compound                               

Name
(S)-Tetrahydropapaverine
Formula
C20H25NO4
Exact mass
343.1784
Mol weight
343.4168
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00950  Isoquinoline alkaloid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Other DBs
PubChem: 340650294
PDB-CCD: S9T[PDBj]
KCF data Show

ATOM        25
            1   C8y C    17.4334  -17.5734
            2   C8y C    17.4334  -18.9737
            3   C1y C    18.6236  -16.8733
            4   C8x C    16.2431  -16.8733
            5   C8x C    16.2431  -19.6738
            6   C1x C    18.6236  -19.6738
            7   C1b C    18.6236  -15.4030
            8   N1x N    19.7438  -17.5734
            9   C8y C    14.9829  -17.5734
            10  C8y C    14.9829  -18.9737
            11  C1x C    19.8138  -18.9737
            12  C8y C    19.8839  -14.7729
            13  O2a O    13.7927  -16.8033
            14  O2a O    13.7927  -19.6738
            15  C8x C    21.0741  -15.4730
            16  C8x C    19.8839  -13.3726
            17  C1a C    12.5324  -18.9737
            18  C8y C    22.2643  -14.7729
            19  C8x C    21.0741  -12.6725
            20  C8y C    22.2643  -13.3726
            21  O2a O    23.5246  -15.4730
            22  O2a O    23.5246  -12.6725
            23  C1a C    24.7148  -13.3726
            24  C1a C    12.6024  -17.5034
            25  C1a C    24.7370  -14.7730
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1 #Down
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    6  11 1
            11    7  12 1
            12    9  13 1
            13   10  14 1
            14   12  15 2
            15   12  16 1
            16   14  17 1
            17   15  18 1
            18   16  19 2
            19   18  20 2
            20   18  21 1
            21   20  22 1
            22   22  23 1
            23    8  11 1
            24    9  10 2
            25   19  20 1
            26   13  24 1
            27   21  25 1

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