KEGG COMPOUND: C21543


KEGG COMPOUND: C21543


KEGG     COMPOUND: C21543
Entry
C21543                      Compound                               
Name
Formula

C24H26N6O3

Exact mass

446.2066

Mol weight

446.5016

Structure
Remark
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01925  Renin-angiotensin system inhibitor
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
     D05246  Olmesartan
  DG03231  Antihypertensive
   DG01495  Angiotensin II receptor antagonist
    DG01544  Olmesartan
     D05246  Olmesartan
 Transporter substrate
  DG01665  ABCB1 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
  DG02861  ABCC2 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
  DG01913  ABCG2 substrate
   DG01544  Olmesartan
    D05246  Olmesartan
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Angiotensin
    AGTR1
     D05246  Olmesartan (USAN/INN)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug transporters
  D05246
Prodrugs [br08324.html]
 D05246

Other DBs
KCF data

ATOM        33
            1   C1d C    23.6905  -18.1341
            2   C8y C    22.9897  -16.9203
            3   O1a O    22.9897  -19.3481
            4   C6a C    20.8871  -18.1341
            5   O6a O    21.5881  -19.3481
            6   C8y C    21.5881  -16.9203
            7   C1b C    19.9415  -14.8810
            8   C8y C    18.7241  -15.5757
            9   N4y N    21.1519  -15.5880
            10  N5x N    23.4261  -15.5880
            11  C8y C    22.2889  -14.7610
            12  C8x C    17.5161  -14.8662
            13  C8x C    16.2987  -15.5608
            14  C8y C    16.2915  -16.9624
            15  C8x C    17.5019  -17.6695
            16  C8x C    18.7194  -16.9748
            17  C8y C    15.0741  -17.6571
            18  C8y C    13.8678  -16.9449
            19  C8x C    12.6505  -17.6397
            20  C8x C    12.7134  -19.0414
            21  C8x C    13.8537  -19.7483
            22  C8x C    15.0711  -19.0536
            23  C8y C    13.8784  -15.5433
            24  N5x N    15.0210  -14.7250
            25  N5x N    14.5978  -13.3888
            26  N5x N    13.1962  -13.3786
            27  N4x N    12.7531  -14.7082
            28  C1a C    24.6746  -17.1325
            29  C1a C    24.6746  -19.1219
            30  O6a O    19.4855  -18.1341
            31  C1b C    22.2889  -13.3594
            32  C1b C    21.0750  -12.6585
            33  C1a C    19.8609  -13.3594
BOND        36
            1    12  13 1
            2    13  14 2
            3    14  15 1
            4    15  16 2
            5    16   8 1
            6     4   6 1
            7    14  17 1
            8     7   8 1
            9     7   9 1
            10   17  18 2
            11   18  19 1
            12   19  20 2
            13   20  21 1
            14   21  22 2
            15   22  17 1
            16    1   2 1
            17   18  23 1
            18    2  10 1
            19   10  11 2
            20   11   9 1
            21   23  24 2
            22   24  25 1
            23   25  26 2
            24   26  27 1
            25   27  23 1
            26    9   6 1
            27    6   2 2
            28    1  28 1
            29    1   3 1
            30    1  29 1
            31    4  30 2
            32    4   5 1
            33   11  31 1
            34   31  32 1
            35    8  12 2
            36   32  33 1

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