KEGG   COMPOUND: C11794Help
Entry
C11794                      Compound                               

Name
Diprenorphine
Formula
C26H35NO4
Exact mass
425.2566
Mol weight
425.5604
Structure
Mol fileKCF fileDB search
Remark
Same as: D07863
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D07863  Diprenorphine (INN)
    OPRK1
     D07863  Diprenorphine (INN)
BRITE hierarchy
Other DBs
CAS: 14357-78-9
PubChem: 13958
ChEBI: 4650
ChEMBL: CHEMBL281786
NIKKAJI: J87.543K
LinkDB All DBs
KCF data Show

ATOM        31
            1   C1z C    20.7900  -22.4000
            2   C1z C    21.9800  -23.1000
            3   C1y C    19.6000  -23.1000
            4   C8y C    20.7900  -21.0700
            5   C1x C    21.9800  -21.7000
            6   C1y C    23.1700  -22.4000
            7   C1x C    21.9800  -24.5000
            8   C1x C    21.4200  -24.1500
            9   C1z C    19.6000  -24.4300
            10  O2x O    18.9700  -21.5600
            11  C8y C    19.6700  -20.3700
            12  C8y C    22.0500  -20.3700
            13  C1x C    24.3600  -21.7000
            14  N1y N    24.3600  -23.1000
            15  C1x C    23.2400  -21.0700
            16  C1y C    20.7900  -25.1300
            17  C1x C    20.2300  -23.4500
            18  C8y C    19.6700  -18.9700
            19  C8x C    22.0500  -18.9700
            20  C1b C    25.5500  -22.4700
            21  C8x C    20.8600  -18.2700
            22  O1a O    18.4800  -18.2700
            23  C1y C    26.7400  -23.1700
            24  C1x C    27.4400  -24.3600
            25  C1x C    28.1400  -23.1700
            26  C1d C    21.4900  -26.3200
            27  C1a C    22.8900  -26.3200
            28  C1a C    20.7900  -27.5100
            29  O1a O    22.1900  -27.5100
            30  C1a C    17.2200  -24.4300
            31  O2a O    18.4100  -25.1300
BOND        37
            1     1   5 1 #Up
            2     2   6 1
            3     2   7 1
            4     2   8 1 #Down
            5     3   9 1
            6     3  10 1 #Down
            7     4  11 1
            8     4  12 2
            9     5  13 1
            10    6  14 1 #Up
            11    6  15 1
            12    7  16 1
            13    8  17 1
            14   11  18 2
            15   12  19 1
            16   14  20 1
            17   18  21 1
            18   18  22 1
            19    9  16 1
            20    9  17 1 #Down
            21   10  11 1
            22   12  15 1
            23   14  13 1 #Up
            24   19  21 2
            25    1   2 1
            26   20  23 1
            27    1   3 1
            28    1   4 1
            29   23  24 1
            30   23  25 1
            31   25  24 1
            32   16  26 1
            33   26  27 1
            34   26  28 1
            35   26  29 1
            36   30  31 1
            37   31   9 1

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