KEGG   DRUG: EstradiolHelp
Entry
D00105                      Drug                                   

Name
Estradiol (JAN/USP/INN);
Climara (TN);
Divigel (TN);
Estrace (TN);
Estraderm (TN);
Estrasorb (TN);
Estring (TN);
Estrogel (TN);
Innofem (TN);
Vagifem (TN);
Vivelle (TN)
Product
  Generic
ESTRADIOL (A-S Medication Solutions), ESTRADIOL (A-S Medication Solutions), ESTRADIOL (Actavis Pharma), ESTRADIOL (Aidarex Pharmaceuticals LLC), ESTRACE (Allergan), ESTRACE (Allergan), YUVAFEM (Amneal Pharmaceuticals LLC), YUVAFEM (Amneal Pharmaceuticals LLC), ESTRADIOL (Amneal Pharmaceuticals of New York LLC), YUVAFEM (AvKARE), ESTRADIOL (Blenheim Pharmacal), ESTRADIOL (Bryant Ranch Prepack), ESTRADIOL (Bryant Ranch Prepack), ESTRADIOL (Bryant Ranch Prepack), ESTRADIOL (Bryant Ranch Prepack), ESTRADIOL (DirectRX), ESTRADIOL (DirectRX), ESTRADIOL (Epic Pharma), ESTRADIOL (Golden State Medical Supply), ESTRADIOL (Heritage Pharmaceuticals), ESTRADIOL VAGINAL (Impax Generics), ESTRADIOL (KAISER FOUNDATION HOSPITALS), ESTRADIOL (KAISER FOUNDATION HOSPITALS), ESTRADIOL (KAISER FOUNDATION HOSPITALS), ESTRADIOL (Lake Erie Medical DBA Quality Care Products LLC), ESTRADIOL (Lake Erie Medical DBA Quality Care Products LLC), ESTRADIOL (Lake Erie Medical DBA Quality Care Products LLC), ESTRADIOL (Mayne Pharma), ESTRADIOL (Mylan Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (NuCare Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (PD-Rx Pharmaceuticals), ESTRADIOL (Physicians Total Care), ESTRADIOL (Physicians Total Care), ESTRADIOL (Preferred Pharmaceuticals), ESTRADIOL (Preferred Pharmaceuticals), ESTRADIOL (Preferred Pharmaceuticals), ESTRADIOL (Preferred Pharmaceuticals), ESTRADIOL (Proficient Rx LP), ESTRADIOL (Proficient Rx LP), ESTRADIOL (REMEDYREPACK), ESTRADIOL (REMEDYREPACK), ESTRADIOL (ReadyMeds), ESTRADIOL (Rebel Distributors Corp), ESTRADIOL (Sandoz), ESTRADIOL (Teva Pharmaceuticals USA), ESTRADIOL (Teva Pharmaceuticals USA)
Formula
C18H24O2
Exact mass
272.1776
Mol weight
272.382
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01584  Estrogen receptor agonist
 DG01986  Estrogen
Cyp substrate
 DG01633  CYP3A substrate
Remark
Same as: C00951
Therapeutic category: 2473
ATC code: G03CA03
Chemical structure group: DG00462
Product (DG00462): D00105<JP/US> D01413<JP/US> D04061<US> D04063<US> D07918<US>
Product (mixture): D09187<JP/US> D09188<JP/US>
Efficacy
Menstruation disorder agent, Estrogen receptor agonist
  Disease
Postmenopausal osteoporosis [DS:H01593]
Primary ovarian failure [DS:H00627]
Comment
Estrogen
Target
NR3A (ESR) [HSA:2099 2100] [KO:K08550 K08551]
  Pathway
hsa04915  Estrogen signaling pathway
hsa04961  Endocrine and other factor-regulated calcium reabsorption
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Structure map
map07047  Osteoporosis drugs
map07226  Progesterone, androgen and estrogen receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
   G03C ESTROGENS
    G03CA Natural and semisynthetic estrogens, plain
     G03CA03 Estradiol
      D00105  Estradiol (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Sex Hormones/Modifiers)
  Estrogens
   Estradiol
    D00105  Estradiol (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  24  Hormones
   247  Estrogen and progesterone preparations
    2473  Estradiols
     D00105  Estradiol (JAN/USP/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Drugs for women
  51 Other drugs for women
   D00105  Estradiol (JAN/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Designated second-class OTC drugs
  Inorganic and organic chemicals
   Estradiol
    D00105  Estradiol (JAN/USP/INN)
 Second-class OTC drugs
  Inorganic and organic chemicals
   Estradiol
    D00105  Estradiol (JAN/USP/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   Estrogen receptor
    NR3A (ESR)
     D00105  Estradiol (JAN/USP/INN) <JP/US>
Drug classes of therapeutic agents [br08360.html]
 Osteoporosis drugs
  D00105
 Endocrine and hormonal agents
  D00105
BRITE hierarchy
Other DBs
CAS: 50-28-2
PubChem: 7847173
ChEBI: 16469
ChEMBL: CHEMBL135
DrugBank: DB00783
PDB-CCD: EST[PDBj]
LigandBox: D00105
NIKKAJI: J4.100I
KCF data Show

ATOM        20
            1   C8x C    19.0779  -11.8363
            2   C8y C    19.0779  -13.2006
            3   C8x C    20.2594  -13.8828
            4   C8y C    21.4411  -13.2006
            5   C8y C    21.4411  -11.8363
            6   C8x C    20.2594  -11.1541
            7   C1x C    22.6226  -13.8828
            8   C1x C    23.8041  -13.2006
            9   C1y C    23.8041  -11.8363
            10  C1y C    22.6226  -11.1541
            11  C1y C    24.9857  -11.1541
            12  C1z C    24.9857   -9.7898
            13  C1x C    23.8041   -9.1076
            14  C1x C    22.6226   -9.7898
            15  C1x C    27.3487  -11.1541
            16  C1x C    27.3487   -9.7898
            17  C1y C    26.1672   -9.1076
            18  O1a O    26.1672   -7.7433
            19  O1a O    17.8964  -13.8828
            20  C1a C    24.9857   -8.4255
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 1
            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   17  18 1 #Up
            22    2  19 1
            23   12  20 1 #Up

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