KEGG   DRUG: Eldacimibe
Entry
D03734                      Drug                                   
Name
Eldacimibe (USAN/INN)
Formula
C39H58N2O5
Exact mass
634.4346
Mol weight
634.89
Structure
Efficacy
Antihyperlipidemic, Cholesterol acyltransferase (ACAT) inhibitor
Target
SOAT [HSA:6646 8435] [KO:K00637]
  Pathway
hsa00100  Steroid biosynthesis
hsa04979  Cholesterol metabolism
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Transferases (EC2)
   Acyltransferases
    SOAT
     D03734  Eldacimibe (USAN/INN)
Other DBs
CAS: 141993-70-6
PubChem: 17397823
LigandBox: D03734
NIKKAJI: J2.423.532G
LinkDB
KCF data

ATOM        46
            1   C2y C    30.9735  -13.9182
            2   C2c C    30.9735  -15.3229
            3   N1c N    29.7795  -16.0252
            4   N1b N    32.1674  -16.0252
            5   C7x C    32.1674  -13.2159
            6   O7x O    32.1674  -11.8113
            7   C1z C    30.9735  -11.1089
            8   O7x O    29.7795  -11.8113
            9   C7x C    29.7795  -13.2159
            10  O6a O    33.3613  -13.9182
            11  O6a O    28.5856  -13.9182
            12  C1b C    28.5856  -15.3229
            13  C1b C    27.3214  -16.0252
            14  C1b C    26.1275  -15.3229
            15  C1b C    24.9335  -16.0252
            16  C1b C    23.6694  -15.3229
            17  C1a C    22.4753  -16.0252
            18  C1b C    29.7795  -17.4298
            19  C8y C    28.5856  -18.1322
            20  C8x C    27.3916  -17.4298
            21  C8x C    26.1275  -18.1322
            22  C8y C    26.1275  -19.5368
            23  C8x C    27.3916  -20.2392
            24  C8x C    28.5856  -19.5368
            25  C1b C    24.9335  -20.2392
            26  C1d C    23.6694  -19.5368
            27  C1a C    22.4753  -18.8345
            28  C8y C    33.5721  -16.0252
            29  C8x C    34.2744  -17.2416
            30  C8y C    35.6791  -17.2416
            31  C8y C    36.3814  -16.0252
            32  C8y C    35.6791  -14.8088
            33  C8x C    34.2744  -14.8088
            34  C1d C    36.3717  -13.6093
            35  C1d C    36.3717  -18.4411
            36  C1a C    37.0741  -12.3928
            37  C1a C    37.0741  -19.6576
            38  O1a O    37.7816  -16.0252
            39  C1a C    37.5951  -14.3161
            40  C1a C    35.1714  -12.9158
            41  C1a C    37.6208  -17.7202
            42  C1a C    35.1955  -19.1200
            43  C1a C    22.9748  -20.7516
            44  C1a C    24.3647  -18.3207
            45  C1a C    29.7611  -10.4089
            46  C1a C    32.1860  -10.4089
BOND        48
            1     1   2 2
            2     2   3 1
            3     2   4 1
            4     1   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     1   9 1
            10    5  10 2
            11    9  11 2
            12    3  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18    3  18 1
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   22  23 1
            24   23  24 2
            25   19  24 1
            26   22  25 1
            27   25  26 1
            28   26  27 1
            29    4  28 1
            30   28  29 2
            31   29  30 1
            32   30  31 2
            33   31  32 1
            34   32  33 2
            35   28  33 1
            36   32  34 1
            37   30  35 1
            38   34  36 1
            39   35  37 1
            40   31  38 1
            41   34  39 1
            42   34  40 1
            43   35  41 1
            44   35  42 1
            45   26  43 1
            46   26  44 1
            47    7  45 1
            48    7  46 1

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