KEGG   COMPOUND: C06846Help
Entry
C06846                      Compound                               

Name
Benztropine;
Benzatropine
Formula
C21H25NO
Exact mass
307.1936
Mol weight
307.4293
Structure
Mol fileKCF fileDB search
Remark
Same as: D07511
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N04 ANTI-PARKINSON DRUGS
   N04A ANTICHOLINERGIC AGENTS
    N04AC Ethers of tropine or tropine derivatives
     N04AC01 Benzatropine
      D07511  Benzatropine (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D07511  Benzatropine (INN)
BRITE hierarchy
Other DBs
CAS: 86-13-5
PubChem: 9064
ChEBI: 3048
ChEMBL: CHEMBL1201203 CHEMBL438151
PDB-CCD: CXQ[PDBj]
NIKKAJI: J4.933F
LinkDB All DBs
KCF data Show

ATOM        23
            1   C1x C    14.4414  -15.7235
            2   C1x C    14.7482  -14.6278
            3   C1y C    15.5371  -15.4606
            4   C1y C    15.8437  -14.3649
            5   N1y N    14.6606  -13.1379
            6   C1x C    17.2900  -15.4606
            7   C1x C    17.0270  -14.3649
            8   C1y C    18.2541  -15.9865
            9   O2a O    19.2621  -16.8191
            10  C1a C    13.9602  -12.0305
            11  C1c C    20.6145  -16.8191
            12  C8y C    21.3090  -18.0217
            13  C8y C    21.2809  -15.6660
            14  C8x C    22.6590  -15.6670
            15  C8x C    23.3360  -14.4963
            16  C8x C    22.6606  -13.3245
            17  C8x C    21.2826  -13.3235
            18  C8x C    20.6055  -14.4942
            19  C8x C    20.6411  -19.1786
            20  C8x C    21.3172  -20.3499
            21  C8x C    22.6697  -20.3500
            22  C8x C    23.3376  -19.1931
            23  C8x C    22.6614  -18.0218
BOND        26
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1
            6     4   7 1
            7     6   8 1
            8     8   9 1 #Down
            9     4   5 1
            10    7   8 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   11  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   13  18 1
            21   12  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   12  23 1

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