KEGG   COMPOUND: C06535Help
Entry
C06535                      Compound                               

Name
Physostigmine;
Eserine
Formula
C15H21N3O2
Exact mass
275.1634
Mol weight
275.3461
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Biosynthesis of alkaloids derived from shikimate pathway
Biosynthesis of secondary metabolites
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Pyrroloindole alkaloids
    C06535  Physostigmine
Target-based classification of compounds [BR:br08010]
 Enzymes
  Hydrolases
   ACHE; acetylcholinesterase
    C06535  Physostigmine
   BCHE; cholinesterase
    C06535  Physostigmine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EB Parasympathomimetics
     S01EB05 Physostigmine
      D00196  Physostigmine (USP)
 V VARIOUS
  V03 ALL OTHER THERAPEUTIC PRODUCTS
   V03A ALL OTHER THERAPEUTIC PRODUCTS
    V03AB Antidotes
     V03AB19 Physostigmine
      D00196  Physostigmine (USP)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   acetylcholinesterase (AChE)
    Physostigmine
     D00196  Physostigmine (USP)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from tryptophan and anthranillic acid
   Pyrroloindole alkaloids
    D00196  Physostigmine (USP)
BRITE hierarchy
Other DBs
CAS: 
57-47-6
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        20
            1   C1z C    26.1396  -14.1174
            2   C8y C    24.8762  -14.5385
            3   C1y C    26.9819  -15.2404
            4   C1x C    26.9819  -12.9242
            5   C1a C    25.2973  -12.9943
            6   C8y C    24.8762  -15.9423
            7   C8x C    23.6128  -13.8366
            8   N1y N    26.1396  -16.3635
            9   N1y N    28.3155  -14.8193
            10  C1x C    28.3155  -13.3453
            11  C8x C    23.6128  -16.6442
            12  C8y C    22.4195  -14.5385
            13  C1a C    26.5608  -17.6971
            14  C8x C    22.4195  -15.9423
            15  O7a O    21.2264  -13.8366
            16  C7a C    20.0332  -14.5385
            17  N1b N    18.8399  -13.8366
            18  O6a O    20.0332  -15.9423
            19  C1a C    17.5765  -14.5385
            20  C1a C    29.4386  -15.5914
BOND        22
            1    16  17 1
            2    16  18 2
            3    17  19 1
            4     6   8 1
            5     9  10 1
            6    12  14 1
            7     1   2 1
            8     1   3 1
            9     1   4 1
            10    1   5 1 #Up
            11    2   6 2
            12    2   7 1
            13    3   8 1
            14    3   9 1
            15    4  10 1
            16    6  11 1
            17    7  12 2
            18    8  13 1
            19   11  14 2
            20   12  15 1
            21   15  16 1
            22    9  20 1

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