KEGG   COMPOUND: C22782
Entry
C22782                      Compound                               
Name
Cumyl-PEGACLONE;
5-Pentyl-2-(2-phenylpropan-2-yl)-2,5-dihydro-1H-pyrido[4,3-b]indol-1-one
Formula
C25H28N2O
Exact mass
372.2202
Mol weight
372.50
Structure
Brite
Narcotics and psychotropics in Japan [br08308.html]
 Narcotics by Cabinet Order Article 1 (163 substances)
  C22782
Other DBs
CAS: 2160555-55-3
PubChem: 497620137
LinkDB
KCF data

ATOM        28
            1   C8x C    14.5600  -14.9800
            2   C8x C    14.5600  -16.3800
            3   C8x C    15.6800  -17.0800
            4   C8y C    16.9400  -16.3800
            5   C8y C    16.9400  -14.9800
            6   C8x C    15.6800  -14.2800
            7   N4y N    18.3400  -16.8000
            8   C8y C    19.1800  -15.6800
            9   C8y C    18.3400  -14.5600
            10  C1b C    18.9000  -18.2000
            11  C1b C    20.7900  -19.5300
            12  C1b C    20.3000  -18.3400
            13  C1a C    22.6100  -20.9300
            14  C1b C    22.1200  -19.7400
            15  C8x C    20.5100  -15.4700
            16  C8x C    21.0700  -14.2100
            17  N4y N    20.2300  -13.0900
            18  C8y C    18.9000  -13.3000
            19  C1d C    20.7900  -11.8300
            20  C8y C    22.1900  -11.4800
            21  C1a C    20.7900  -10.4300
            22  C1a C    21.7700  -12.8100
            23  C8x C    23.1700  -12.4600
            24  C8x C    24.5000  -12.1100
            25  C8x C    24.9200  -10.7800
            26  C8x C    23.8700   -9.7300
            27  C8x C    22.5400  -10.0800
            28  O5x O    18.0476  -12.1894
BOND        31
            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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    7  10 1
            12   11  12 1
            13   10  12 1
            14   13  14 1
            15   11  14 1
            16    8  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 1
            20    9  18 1
            21   17  19 1
            22   19  20 1
            23   19  21 1
            24   19  22 1
            25   20  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   26  27 2
            30   20  27 1
            31   18  28 2

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