KEGG   DRUG: Cariporide mesylate
Entry
D03406                      Drug                                   

Name
Cariporide mesylate (USAN)
Formula
C12H17N3O3S. CH4SO3
Exact mass
379.0872
Mol weight
379.4523
Structure
Efficacy
Cardioprotectant, Na+/H+ antiport inhibitor
Comment
Reduction of death and nonfatal myocardial infarction in patients undergoing
Target
SLC9A1 (NHE1) [HSA:6548] [KO:K05742]
  Pathway
hsa04260  Cardiac muscle contraction
hsa04261  Adrenergic signaling in cardiomyocytes
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC9
    SLC9A1 (NHE1)
     D03406  Cariporide mesylate (USAN)
Other DBs
CAS: 159138-81-5
PubChem: 17397546
ChEMBL: CHEMBL462831
LigandBox: D03406
NIKKAJI: J816.827J
LinkDB
KCF data

ATOM        24
            1   C8y C    32.1927  -17.9669
            2   C8y C    32.1927  -19.3594
            3   C8x C    31.0090  -20.0556
            4   C8x C    29.7558  -19.3594
            5   C8y C    29.7558  -17.9669
            6   C8x C    31.0090  -17.2706
            7   C5a C    28.5722  -17.2706
            8   C1c C    33.3763  -20.0556
            9   C1a C    34.5599  -19.3594
            10  C1a C    33.3763  -21.4481
            11  N2b N    27.3886  -17.9669
            12  O5a O    28.5722  -15.8781
            13  C2c C    26.2049  -17.2706
            14  N1a N    25.0213  -17.9669
            15  N1a N    26.2049  -15.8781
            16  S4a S    33.5851  -17.0618
            17  C1a C    34.8520  -17.7064
            18  O1d O    34.5751  -16.0718
            19  O1d O    32.5952  -16.0718
            20  C1a C    40.3670  -18.7968
            21  S4a S    41.7536  -18.7968
            22  O1d O    41.7536  -17.4103
            23  O1d O    43.1401  -18.7968
            24  O1d O    41.7536  -20.1834
BOND        23
            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     5   7 1
            8     2   8 1
            9     8   9 1
            10    8  10 1
            11    7  11 1
            12    7  12 2
            13   11  13 2
            14   13  14 1
            15   13  15 1
            16    1  16 1
            17   16  17 1
            18   16  18 2
            19   16  19 2
            20   20  21 1
            21   21  22 2
            22   21  23 1
            23   21  24 2

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