KEGG   COMPOUND: C07522Help
Entry
C07522                      Compound                               

Name
Etomidate;
1-(1-Phenylethyl)-imidazole-5-carboxylic acid, ethyl ester
Formula
C14H16N2O2
Exact mass
244.1212
Mol weight
244.289
Structure
Mol fileKCF fileDB search
Remark
Same as: D00548
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01A ANESTHETICS, GENERAL
    N01AX Other general anesthetics
     N01AX07 Etomidate
      D00548  Etomidate (USAN/INN) <US>
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   GABA (ionotropic)
    GABRA1
     D00548  Etomidate (USAN/INN) <US>
Drug classes of therapeutic agents [br08360.html]
 Anesthetics, analgesics and anti-inflammatory drugs
  D00548
BRITE hierarchy
Other DBs
CAS: 33125-97-2
PubChem: 9725
ChEBI: 4910
ChEMBL: CHEMBL681
NIKKAJI: J17.549H
LinkDB All DBs
KCF data Show

ATOM        18
            1   N4y N    18.6257  -16.4148
            2   C8y C    19.9646  -16.0098
            3   C1c C    17.3975  -15.7072
            4   C8x C    18.6034  -17.8220
            5   C8x C    20.7542  -17.1565
            6   C8y C    16.1867  -16.4148
            7   C1a C    17.3975  -14.3091
            8   N5x N    19.9266  -18.2742
            9   C8x C    14.9760  -15.7072
            10  C8x C    16.1867  -17.8069
            11  C8x C    13.7594  -16.4148
            12  C8x C    14.9760  -18.5087
            13  C8x C    13.7654  -17.8186
            14  C7a C    19.9646  -14.6102
            15  O7a O    21.1523  -13.9246
            16  O6a O    18.7443  -13.9054
            17  C1b C    22.3512  -14.6170
            18  C1a C    23.5365  -13.9327
BOND        19
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 1 #Up
            7     4   8 2
            8     6   9 2
            9     6  10 1
            10    9  11 1
            11   10  12 2
            12   11  13 2
            13    5   8 1
            14   12  13 1
            15    2  14 1
            16   14  15 1
            17   14  16 2
            18   15  17 1
            19   17  18 1

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