KEGG   DRUG: EquilinHelp
Entry
D04041                      Drug                                   

Name
Equilin (USP)
Formula
C18H20O2
Exact mass
268.1463
Mol weight
268.3502
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Other
 DG01584  Estrogen receptor agonist
 DG01986  Estrogen
Remark
Same as: C14392
Efficacy
Replenisher (estrogen), Estrogen receptor agonist
Target
NR3A (ESR) [HSA:2099 2100] [KO:K080550 K08551]
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   Estrogen receptor
    estrogen receptor 1
     Equilin
      D04041  Equilin (USP)
    estrogen receptor 2
     Equilin
      D04041  Equilin (USP)
BRITE hierarchy
Other DBs
CAS: 474-86-2
PubChem: 47206005
ChEBI: 42309
ChEMBL: CHEMBL323533
DrugBank: DB02187
PDB-CCD: EQI[PDBj]
LigandBox: D04041
NIKKAJI: J5.967F
LinkDB All DBs
KCF data Show

ATOM        20
            1   C8x C    18.3132  -18.0007
            2   C8y C    18.3132  -19.3569
            3   C8x C    19.4876  -20.0349
            4   C8y C    20.6620  -19.3569
            5   C8y C    20.6620  -18.0007
            6   C8x C    19.4876  -17.3228
            7   C1x C    21.8364  -20.0349
            8   C2x C    23.0108  -19.3569
            9   C2y C    23.0108  -18.0007
            10  C1y C    21.8364  -17.3228
            11  C1y C    24.1853  -17.3228
            12  C1z C    24.1853  -15.9666
            13  C1x C    23.0108  -15.2886
            14  C1x C    21.8364  -15.9666
            15  C1x C    26.5340  -17.3228
            16  C1x C    26.5340  -15.9666
            17  C5x C    25.3596  -15.2886
            18  C1a C    24.1421  -14.6107
            19  O5x O    25.3648  -13.9325
            20  O1a O    17.0973  -20.0591
BOND        23
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21   12  18 1 #Up
            22   17  19 2
            23    2  20 1

» Japanese version   » Back

DBGET integrated database retrieval system