Drug Information
| General Information | ||||||
|---|---|---|---|---|---|---|
| Drug ID |
DR00129
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| Drug Name |
Estradiol
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| Synonyms |
17 beta-Estradiol; 17-.BETA.-Estradiol; 17-beta-OH-estradiol; 17-beta-estradiol; 17.beta.-Estradiol; 17.beta.-Oestradiol; 17b-Oestradiol; 17beta oestradiol; 17beta-Estradiol; 17beta-Oestradiol; 3,17-beta-Estradiol; 3,17-beta-Oestradiol; 3,17.beta.-Estradiol; 3,17beta-Estradiol; Activella (TN); Aerodiol; Alora; Alora (TN); Alpha-Estradiol; Alpha-Oestradiol; Altrad; AngeliQ (TN); Aquadiol; B-Estradiol; Bardiol; Beta-Oestradiol; Beta-estradiol; CMC_11154; Cis-Estradiol; Cis-Oestradiol; Climaderm; Climara; Climara (TN); Climara Forte; Component of Menrium; Compudose; Compudose 200; Compudose 365; Corpagen; D-3,17beta-Estradiol; D-Estradiol; D-Oestradiol; Dermestril; Destradiol; Dihydrofolliculin; Dihydromenformon; Dihydrotheelin; Dihydroxyesterin; Dihydroxyestrin; Dihydroxyoestrin; Dimenformon; Diogyn; Diogynets; Divigel; Divigel (TN); E 2; E 8875; E(sub 2); E0025; Elestrin; Elestrin (TN); Encore; Epiestriol 50; Esclim; Estrace; Estrace (TN); Estraderm; Estraderm (TN); Estraderm MX; Estraderm TTS; Estraderm TTS (TN); Estraderm TTS 100; Estraderm TTS 50; Estradiol [USAN:INN]; Estradiol acetate (TN); Estradiol cypionate (TN); Estradiol valerate (TN); Estradiol-17 beta; Estradiol-17-beta; Estradiol-17beta; Estradiol-3,17beta; Estradiolo; Estradiolo [DCIT]; Estradiolum; Estradiolum [INN]; Estradot; Estraldine; Estrapak 50; Estrasorb; Estrasorb (TN); Estrasorb Topical (TN); Estreva; Estrifam; Estring; Estring (TN); Estring vaginal ring; Estroclim; Estroclim 50; Estrodiolum; Estrofem (TN); Estrofem 2; Estrofem Forte; Estrogel; Estrogel (TN); Estrovite; EvaMist (TN); Evamist; Evorel; Extrasorb; Femanest; Femestral; Femestrol; Femogen; Fempatch; Femring (TN); Femtrace; Femtran; Follicyclin; Gelestra; Ginedisc; Ginosedol; GynPolar; Gynergon; Gynestrel; Gynodiol; Gynoestryl; Innofem; Innofem (TN); Lamdiol; Macrodiol; Macrol; Menest; Menorest; Menostar (TN); Microdiol; Nordicol; Oesclim; Oestergon; Oestradiol; Oestradiol Berco; Oestradiol R; Oestradiol-17-beta; Oestradiol-17beta; Oestradiolum; Oestrogel; Oestroglandol; Oestrogynal; Ovahormon; Ovasterol; Ovastevol; Ovociclina; Ovocyclin; Ovocycline; Ovocylin; Perlatanol; Polyestradiol; Primofol; Profoliol; Profoliol B; Progynon DH; Progynon-DH; Progynon;Syndiol; Progynova (TN); S-21400; SK-Estrogens; SL-1100; Sandrena 1; Sandrena Gel; Sisare Gel; Systen; Tradelia; Trial SAT; Trocosone; VIVELLE-DOT; Vagifem; Vagifem (TN); Vivelle; Vivelle (TN); Vivelle-Dot (TN); Zerella; Zesteem; Zesteen; Zumenon; [2,4,6,7-3H]-E2; [3H]-estradiol; [3H]]estradiol
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| Drug Type |
Small molecular drug
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| Indication | Breast cancer [ICD11:2C60-2C6Z] | Approved | [1] | |||
| Therapeutic Class |
Estrogens
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| Structure |
|
 |
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| 3D MOL | 2D MOL | |||||
| Formula |
C18H24O2
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| Canonical SMILES |
CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
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| InChI |
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
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| InChIKey |
VOXZDWNPVJITMN-ZBRFXRBCSA-N
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| CAS Number |
CAS 50-28-2
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| Pharmaceutical Properties | Molecular Weight | 272.4 | Topological Polar Surface Area | 40.5 | ||
| Heavy Atom Count | 20 | Rotatable Bond Count | 0 | |||
| Hydrogen Bond Donor Count | 2 | Hydrogen Bond Acceptor Count | 2 | |||
| XLogP |
4
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| PubChem CID | ||||||
| PubChem SID |
10321307
,11110639
,11120283
,11120771
,11121259
,11121708
,11122188
,11362819
,11364683
,11365381
,11367245
,11367943
,11369807
,11370869
,11370870
,11372848
,11373544
,11375407
,11376105
,11377970
,11466469
,11467589
,11486157
,12012600
,14799365
,14799367
,17389898
,17405066
,2384
,4202
,4266382
,652955
,75249
,7847173
,7887363
,8028360
,8139856
,8139865
,8143549
,8153534
,820385
,821147
,823461
,823615
,825708
,829421
,831023
,831024
,838509
,841780
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| ChEBI ID |
ChEBI:16469
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| TTD Drug ID | ||||||
| DT(s) Transporting This Drug | BCRP | Transporter Info | Breast cancer resistance protein | Substrate | [2] | |
| P-GP | Transporter Info | P-glycoprotein 1 | Substrate | [3] | ||
| References | ||||||
| 1 | Estradiol was approved by FDA. The official website of the U.S. Food and Drug Administration. (2019) | |||||
| 2 | Sterol transport by the human breast cancer resistance protein (ABCG2) expressed in Lactococcus lactis. J Biol Chem. 2003 Jun 6;278(23):20645-51. | |||||
| 3 | Antiestrogens and steroid hormones: substrates of the human P-glycoprotein. Biochem Pharmacol. 1994 Jul 19;48(2):287-92. | |||||
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