KEGG   COMPOUND: C16662Help
Entry
C16662                      Compound                               

Name
L-alpha-Acetyl-N,N-dinormethadol;
dinor-LAAM
Formula
C21H27NO2
Exact mass
325.2042
Mol weight
325.4446
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00982  Drug metabolism - cytochrome P450
Enzyme
1.14.13.-
Other DBs
CAS: 54276-34-5
PubChem: 51090986
ChEBI: 80648
ChEMBL: CHEMBL1201402
NIKKAJI: J474.574D
KCF data Show

ATOM        24
            1   C8x C    21.8627  -21.7687
            2   C8x C    21.8627  -23.0990
            3   C8x C    23.0530  -23.7992
            4   C8x C    24.2433  -23.0990
            5   C8y C    24.2433  -21.7687
            6   C8x C    23.0530  -21.0684
            7   C8x C    26.6240  -23.0990
            8   C8y C    26.6240  -21.7687
            9   C1d C    25.4336  -21.0684
            10  C8x C    27.7442  -23.7992
            11  C8x C    28.9345  -23.0990
            12  C8x C    28.9345  -21.7687
            13  C8x C    27.7442  -21.0684
            14  C1b C    25.4336  -19.6681
            15  C1c C    26.6240  -19.0380
            16  C1c C    23.4031  -19.9482
            17  C1a C    27.7442  -19.6681
            18  N1a N    26.6240  -17.6376
            19  O7a O    23.4031  -18.6179
            20  C1b C    22.2128  -20.6484
            21  C1a C    21.0925  -19.9482
            22  C7a C    22.2128  -17.9176
            23  C1a C    21.0225  -18.6179
            24  O6a O    22.2128  -16.5172
BOND        25
            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     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    9  14 1
            16   14  15 1
            17    9  16 1
            18   15  17 1
            19   15  18 1 #Up
            20   16  19 1 #Down
            21   16  20 1
            22   20  21 1
            23   19  22 1
            24   22  23 1
            25   22  24 2

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