KEGG   COMPOUND: C06931Help
Entry
C06931                      Compound                               

Name
Cyclobenzaprine
Formula
C20H21N
Exact mass
275.1674
Mol weight
275.3874
Structure
Mol fileKCF fileDB search
Remark
Same as: D07758
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M03 MUSCLE RELAXANTS
   M03B MUSCLE RELAXANTS, CENTRALLY ACTING AGENTS
    M03BX Other centrally acting agents
     M03BX08 Cyclobenzaprine
      D07758  Cyclobenzaprine (INN)
USP drug classification [BR:br08302]
 Skeletal Muscle Relaxants
  Cyclobenzaprine
   D07758  Cyclobenzaprine (INN)
BRITE hierarchy
Other DBs
CAS: 303-53-7
PubChem: 9148
ChEBI: 3996
ChEMBL: CHEMBL669
NIKKAJI: J5.490I
LinkDB All DBs
KCF data Show

ATOM        21
            1   C2x C    22.3057  -18.3177
            2   C8y C    21.4613  -17.2050
            3   C8y C    21.7974  -15.8445
            4   C2y C    23.0619  -15.2648
            5   C2x C    23.7154  -18.3430
            6   C8y C    24.3189  -15.8888
            7   C8y C    24.6062  -17.2613
            8   C8x C    20.7875  -14.8734
            9   C8x C    19.4418  -15.2626
            10  C8x C    19.1057  -16.6231
            11  C8x C    20.1156  -17.5939
            12  C8x C    25.9410  -17.6996
            13  C8x C    26.9881  -16.7626
            14  C8x C    26.7010  -15.3901
            15  C8x C    25.3659  -14.9518
            16  C2b C    23.0136  -13.8861
            17  C1b C    24.2410  -13.2031
            18  C1b C    25.4126  -13.9045
            19  N1c N    26.6381  -13.2226
            20  C1a C    27.8762  -13.9632
            21  C1a C    26.6602  -11.8505
BOND        23
            1     3   4 1
            2     1   5 2
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    7  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    6  15 2
            18    4  16 2
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   19  21 1

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