KEGG   DRUG: ErtugliflozinHelp
Entry
D10313                      Drug                                   

Name
Ertugliflozin (USAN/INN)
Formula
C22H25ClO7
Exact mass
436.1289
Mol weight
436.8827
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antidiabetic agent
 DG01794  SGLT2 inhibitor
 DG02044  Hypoglycemics
  DG01794  SGLT2 inhibitor
Remark
Chemical structure group: DG02836
Product (DG02836): D11043<US>
Product (mixture): D11066<US> D11067<US>
Efficacy
Antidiabetic, SGLT-2 inhibitor
Comment
Phlorizin derivative
Treatment of type 2 diabetes
Target
SLC5A2 (SGLT2) [HSA:6524] [KO:K14382]
Metabolism
Enzyme: UGT1A9 [HSA:54600], UGT2B7 [HSA:7364]
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC5
    SLC5A2 (SGLT2)
     D10313  Ertugliflozin (USAN/INN)
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D10313
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D10313
BRITE hierarchy
Other DBs
CAS: 1210344-57-2
PubChem: 163312343
ChEMBL: CHEMBL1770248
LinkDB All DBs
KCF data Show

ATOM        30
            1   C8y C    17.9900  -18.1300
            2   C8x C    17.9900  -19.5300
            3   C8x C    19.1800  -20.2300
            4   C8y C    20.4400  -19.5300
            5   C8y C    20.4400  -18.1300
            6   C8x C    19.1800  -17.4300
            7   C1b C    21.6300  -17.4300
            8   C8y C    22.8900  -18.1300
            9   C8x C    22.8900  -19.5300
            10  C8x C    24.0800  -20.2300
            11  C8y C    25.2700  -19.5300
            12  C8x C    25.2700  -18.1300
            13  C8x C    24.0800  -17.4300
            14  X   Cl   21.6300  -20.2300
            15  O2a O    26.4600  -20.2300
            16  C1b C    27.6500  -19.5300
            17  C1a C    28.8400  -20.2300
            18  C1z C    16.8000  -17.4300
            19  O2x O    16.8000  -16.0300
            20  C1z C    15.5400  -15.3300
            21  C1y C    14.3500  -16.0300
            22  C1y C    14.3500  -17.4300
            23  C1y C    15.5400  -18.1300
            24  O1a O    15.5400  -19.5300
            25  O1a O    13.1600  -15.3300
            26  O1a O    13.1600  -18.1300
            27  C1b C    15.5400  -13.9300
            28  O1a O    16.8000  -13.2300
            29  C1x C    17.0324  -14.4200
            30  O2x O    18.5024  -16.3800
BOND        33
            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     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15    4  14 1
            16   11  15 1
            17   15  16 1
            18   16  17 1
            19   18   1 1 #Up
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   18  23 1
            26   23  24 1 #Down
            27   21  25 1 #Down
            28   22  26 1 #Up
            29   20  27 1 #Up
            30   27  28 1
            31   20  29 1 #Down
            32   18  30 1 #Down
            33   29  30 1

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