KEGG   COMPOUND: C09256Help
Entry
C09256                      Compound                               

Name
Yohimbine
Formula
C21H26N2O3
Exact mass
354.1943
Mol weight
354.4427
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C09256  Yohimbine
Target-based classification of compounds [BR:br08010]
 G Protein-coupled receptors
  Rhodopsin family: amine receptors
   Adrenaline
    alpha2a-adrenergic receptor
     C09256  Yohimbine
    alpha2b-adrenergic receptor
     C09256  Yohimbine
    alpha2c-adrenergic receptor
     C09256  Yohimbine
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G04 UROLOGICALS
   G04B UROLOGICALS
    G04BE Drugs used in erectile dysfunction
     G04BE04 Yohimbin
      D08685  Yohimbine (DCF)
Risk category of Japanese OTC drugs [BR:br08312]
 First-class OTC drugs
  Inorganic and organic chemicals
   Yohimbine
    D08685  Yohimbine (DCF)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha2-adrenergic receptor
     Yohimbin
      D08685  Yohimbine (DCF)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from tryptophan and anthranillic acid
   Indole alkaloids
    D08685  Yohimbine (DCF)
BRITE hierarchy
Other DBs
CAS: 
146-48-5
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   C8x C    23.1596  -14.9452
            2   C8x C    23.1927  -16.3249
            3   C8x C    24.4053  -16.9794
            4   C8x C    24.3319  -14.2194
            5   C8y C    25.5516  -14.8804
            6   C8y C    25.5847  -16.2604
            7   C1x C    28.7376  -12.9079
            8   C1x C    27.3612  -13.1077
            9   N1y N    29.5883  -13.9875
            10  C1y C    29.0714  -15.2785
            11  C1x C    29.9278  -16.3675
            12  C1x C    30.9619  -13.7926
            13  C1y C    31.8184  -14.8816
            14  C1y C    31.3012  -16.1660
            15  C1y C    32.1519  -17.2519
            16  C1y C    33.5196  -17.0604
            17  C1x C    34.0368  -15.7830
            18  C1x C    33.1861  -14.6903
            19  C7a C    31.5980  -18.5924
            20  C8y C    27.7090  -15.4852
            21  C8y C    26.8504  -14.4043
            22  N4x N    26.9405  -16.6317
            23  O1a O    34.5475  -18.0863
            24  O7a O    32.4698  -19.7343
            25  C1a C    31.9134  -21.0723
            26  O6a O    30.1880  -18.9595
BOND        30
            1     1   2 1
            2    20  10 1
            3     9   7 1
            4     7   8 1
            5    13  14 1
            6    14  15 1
            7    15  16 1
            8    16  17 1
            9    17  18 1
            10   18  13 1
            11    8  21 1
            12   15  19 1 #Down
            13    2   3 2
            14    3   6 1
            15    5   4 1
            16   20  21 2
            17   21   5 1
            18    6  22 1
            19   22  20 1
            20    4   1 2
            21   16  23 1 #Down
            22    9  10 1
            23   19  24 1
            24   10  11 1
            25   24  25 1
            26   11  14 1
            27   19  26 2
            28   13  12 1
            29   12   9 1
            30    5   6 2

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