KEGG   COMPOUND: C17723Help
Entry
C17723                      Compound                               

Name
Metabutethamine
Formula
C13H20N2O2
Exact mass
236.1525
Mol weight
236.3101
Structure
Mol fileKCF fileDB search
Remark
ATC code: N01BA01
Drug group: DG01674
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01B ANESTHETICS, LOCAL
    N01BA Esters of aminobenzoic acid
     N01BA01 Metabutethamine
      C17723  Metabutethamine
BRITE hierarchy
Other DBs
CAS: 4439-25-2
PubChem: 96024053
ChEBI: 81295
ChEMBL: CHEMBL2110959
NIKKAJI: J8.728I
LinkDB All DBs
KCF data Show

ATOM        17
            1   C8x C    20.5800  -17.9200
            2   C8y C    20.5800  -19.3200
            3   C8x C    21.7924  -20.0200
            4   C8y C    23.0049  -19.3200
            5   C8x C    23.0049  -17.9200
            6   C8x C    21.7924  -17.2200
            7   N1a N    19.3676  -20.0200
            8   C7a C    24.2360  -20.0310
            9   O7a O    25.4412  -19.3353
            10  O6a O    24.2357  -21.4199
            11  C1b C    26.6235  -20.0181
            12  C1b C    27.8175  -19.3288
            13  N1b N    29.0054  -20.0148
            14  C1b C    30.1965  -19.3271
            15  C1c C    31.3859  -20.0139
            16  C1a C    32.5762  -19.3266
            17  C1a C    31.3860  -21.4198
BOND        17
            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     2   7 1
            8     4   8 1
            9     8   9 1
            10    8  10 2
            11    9  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   15  17 1

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