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Diethylstilbestrol

PubChem CID: 448537

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Compound Synonyms diethylstilbestrol, 56-53-1, Stilbestrol, Stilboestrol, Distilbene, Estrobene, Estromenin, Stilbetin, Stilboestroform, Agostilben, Antigestil, Palestrol, Synestrin, Vagestrol, Fonatol, Dietilestilbestrol, Comestrol, Domestrol, Grafestrol, Iscovesco, Milestrol, Oestrogenine, Oestromenin, Oestromensyl, Sexocretin, Stilboefral, Synthoestrin, Synthofolin, Diastyl, Estrosyn, Makarol, Microest, Stilkap, Bufon, Cyren A, Diethylstilbesterol, Serral, Sibol, Dawe's destrol, Hi-Bestrol, Di-Estryl, Neo-Oestranol I, Stil-Rol, Menostilbeen, Oestromienin, Stilbestrone, Acnestrol, Dyestrol, Oestromon, Pabestrol, Stilbofolin, Syntofolin, Micrest, Cyren, Desma, Diethylstilboesterol, OeKolp, trans-Diethylstilbestrol, Bio-des, Rumestrol 1, Rumestrol 2, Climaterine, Dibestrol, Dicorvin, Gynopharm, Idroestril, Oestromensil, Protectona, Sedestran, Sintestrol, Stibilium, Tylosterone, Comestrol estrobene, Stilbol, Oestrol vetag, DiBestrol 2 Premix, Estilbin MCO, neo-Oestranol 1, Synthestrin, Destrol, Estril, trans-Diethylstilbesterol, trans-Diethylstilboesterol, STIL, (E)-3,4-Bis(4-hydroxyphenyl)-3-hexene, Tampovagan stilboestrol, DES, Dibestrol '2' premix, New-Estranol 1, Diethylstilbestrolum, Stilbestroform, Estrogenine, 6898-97-1, DES (synthetic estrogen), Stilbestrol, diethyl-, Percutatrine oestrogenique iscovesco, (E)-4,4'-(hex-3-ene-3,4-diyl)diphenol, 4,4'-Dihydroxydiethylstilbene, diethylstilbestrol (DES), NSC-3070, Rcra waste number U089, Stilbestro, Phenol, 4,4'-[(1E)-1,2-diethyl-1,2-ethenediyl]bis-, Dietilestilbestrol [Spanish], 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol, (E)-Diethylstilbestrol, 4,4'-(3E)-hex-3-ene-3,4-diyldiphenol, alpha,alpha'-Diethylstilbenediol, Stilbestrol (TN), (E)-4,4'-(1,2-Diethyl-1,2-ethenediyl)bisphenol, 4,4'-(Hex-3-ene-3,4-diyl)diphenol, Phenol, 4,4'-(1,2-diethyl-1,2-ethenediyl)bis-, (E)-, 4,4'-Dihydroxy-alpha,beta-diethylstilbene, trans-4,4'-(1,2-Diethyl-1,2-ethenediyl)bisphenol, 3,4-Bis(p-hydroxyphenyl)-3-hexene, alpha,alpha'-Diethyl-(E)-4,4'-stilbenediol, 731DCA35BT, DTXSID3020465, CHEBI:41922, trans-Diethyl Stilbestrol, Diethylstilbestrol BP, CHEMBL411, 4,4'-Stilbenediol, alpha,alpha'-diethyl-, (E)-, DTXCID10465, DIETHYLSTILBESTROL [MI], Phenol 4,4'-(1,2-diethyl-1,2-ethenediyl)bis-, (E)-, DIETHYLSTILBESTROL [INN], Stilbofollin, Tampovagan, DIETHYLSTILBESTROL [HSDB], DIETHYLSTILBESTROL [IARC], DIETHYLSTILBESTROL [VANDF], NSC3070, DIETHYLSTILBESTROL [MART.], DIETHYLSTILBESTROL [USP-RS], DIETHYLSTILBESTROL [WHO-DD], .alpha.,.alpha.'-Diethyl-(E)-4,4'-stilbenediol, cis-Des, Stilbene Estrogen, .alpha.,.alpha.'-Diethylstilbenediol, 4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol, MFCD00002373, Diethyl stilbestrol, E-Diethylstilbestrol, DIETHYLSTILBESTROL [ORANGE BOOK], hibestrol, oestrolmensil, Phenol, 4,4'-((1E)-1,2-diethyl-1,2-ethenediyl)bis-, strobene, Diaethylstilboestrolum, DIETHYLSTILBESTROL [EP MONOGRAPH], NCGC00090749-04, DIETHYLSTILBESTROL [USP MONOGRAPH], Apstil, cis-Diethylstilbesterol, (E,Z)-Diethylstilbestrol, Dietilstilbestrolo, diethylstilboestrol, Estrogen, Stilbene, Dietilstilbestrolo [DCIT], 4,4'-Stilbenediol, .alpha.,.alpha.'-diethyl-, (E)-, DTXCID1020770, DIETHYLSTILBESTROL (IARC), 4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol, DIETHYLSTILBESTROL (MART.), DIETHYLSTILBESTROL (USP-RS), Diethylstilbestrolum [INN-Latin], Dietilestilbestrol [INN-Spanish], DIETHYLSTILBESTROL (EP MONOGRAPH), MG 137, DIETHYLSTILBESTROL (USP MONOGRAPH), SMR000058263, CCRIS 240, CAS-6898-97-1, (Z,E)-Diethylstilbestrol, Estilbin ''MCO'', HSDB 3060, DiBestrol '2' Premix, SR-01000745070, EINECS 200-278-5, RCRA waste no. U089, DTXSID3040770, BRN 2056095, UNII-731DCA35BT, alpha,alpha'-Diethyl-4,4'-stilbenediol, Stilboesterol, Bertrol, Boestrol, Diethylstilbestrol (USP/INN), TRANS-DIETHYSTILBESTEROL, cis-alpha,alpha'-Diethyl-4,4'-stilbenediol, 4,4'-(3-HEXENE-3,4-DIYL)DIPHENOL, Neo-Oestronol I, 3erd, Diethylstilbenediol, CAS-56-53-1, Diethylstilbestrol [USP:INN:BAN], Prestwick_1070, (Z)-4,4'-(1,2-Diethyl-1,2-ethylenediyl)bisphenol, 4-(4-(4-hydroxyphenyl)hex-3-en-3-yl)phenol, 3,4'(4,4'-Dihydroxyphenyl)hex-3-ene, ESTILBIN 'MCO, Phenol, 4,4'-(1,2-diethyl-1,2-ethylenediyl)bis-, (Z)-, Diethylstilbestrol [Nonsteroidal oestrogens], ESTILBIN''MCO'', Prestwick2_000756, Prestwick3_000756, Spectrum5_000799, 4, 2,2'-diethyl-, trans-alpha,alpha'-Diethyl-4,4'-Stilbenediol, (E)-alpha, alpha'-diethyl-4,4'-stilbenediol, SCHEMBL9223, BSPBio_000772, BSPBio_002201, Diethylstilbestrol (Standard), 4,4'-Stilbenediol, alpha,alpha'-diethyl-, (Z)-, MLS000028447, MLS002174252, MLS002222298, BIDD:ER0159, SPECTRUM1500244, BPBio1_000850, GTPL2801, trans-.alpha.,4'-stilbenediol, 4, .alpha.,.alpha.-diethyl-, 4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenol, REGID_for_CID_448537, BDBM20625, CHEBI:92795, HMS501J21, RGLYKWWBQGJZGM-ISLYRVAYSA-, 4, .alpha.,.alpha.'-diethyl-, alpha, alpha'-Diethylstilbenediol, G03CB02, G03CC05, L02AA01, WLN: QR DY2&UY2&R DQ, 3,4'-Dihydroxyphenyl)hex-3-ene, HMS1570G14, HMS1920G08, HMS2090C14, HMS2091M18, HMS2097G14, HMS2232N11, HMS3650A09, HMS3714G14, Pharmakon1600-01500244, 3-Hexene,4-bis(p-hydroxyphenyl)-, NSC 3070, Tox21_111005, Tox21_202407, Tox21_300526, CCG-38961, Diethylstilbestrol, >=99% (HPLC), HY-14598R, MSK011010, NSC756736, s1859, STK366318, 3, 4-Bis(p-hydroxyphenyl)-3-hexene, 3-Hexene,3,4-bis(p-hydroxyphenyl)-, 4,4'-Stilbenediol, 2,2'-diethyl-, AKOS005111142, DIETHYLSTILBESTROL (diethylstilbestr, Tox21_111005_1, .alpha., .alpha.'-Diethylstilbenediol, 4,2-Diethyl-1,2-ethenediyl)bisphenol, DB00255, NSC-756736, 3-Hexene, 3,4-bis(p-hydroxyphenyl)-, IDI1_000519, NCGC00090749-01, NCGC00090749-02, NCGC00090749-03, NCGC00090749-05, NCGC00090749-06, NCGC00090749-07, NCGC00090749-08, NCGC00090749-09, NCGC00090749-12, NCGC00090749-15, NCGC00254539-01, NCGC00259956-01, 4, .alpha.,.alpha.'-diethyl-, (E)-, AS-13377, HY-14598, LS-14649, 2,2'-DIETHYL-4,4'-STILBENEDIOL, BOVINE MUSCLE (diethylstilbestrol blank), SBI-0051346.P003, 1ST011010, 3,4-Bis(p-hydroxyphenyl)-3-hexene, trans, 4,4'-Dihydroxy-alpha, beta-diethylstilbene, 3,4-BIS(PARAHYDROXYPHENYL)-3-HEXENE, CS-0369240, D0526, NS00010902, SW197137-4, .alpha.,.alpha.'-Diethyl-4,4'-stilbenediol, 3,4-(Di-4-hydroxyphenyl)hex-3-ene, (E)-, 3-Hexene,3,4-bis(p-hydroxyphenyl)-, (E)-, Trans-bis-(hydroxy-4-phenyl)-3,4 hexene-3, 4,4'-Dihydroxy-.alpha.,.beta.-diethylstilbene, C07620, D00577, D81873, EN300-120642, 4,4'-Dihydroxy-.alpha., .beta.-diethylstilbene, EN300-1268179, A831077, Q423989, 4,4'-STILBENEDIOL, ALPHA, ALPHA'-DIETHYL-, SR-01000745070-3, SR-01000745070-4, SR-01000745070-5, SR-01000745070-9, trans-.alpha.,.alpha.'-Diethyl-4,4'-stilbenediol, trans-.alpha.,.alpha.'-diethyl-4-4'-stilbenediol, 4,4'-(1,2-Diethyl-1,2-ethenediyl)bisphenol, trans, 4,4'-Stilbenediol, .alpha.,.alpha.-diethyl-, (E)-, 4,4'[(1E)-1,2-diethyl-1,2-ethenediyl]bis-phenol, BRD-K17084514-001-01-7, BRD-K45330754-001-09-2, BRD-K45330754-001-21-7, BRD-K45330754-001-22-5, Diethylstilbestrol, VETRANAL(TM), analytical standard, Phenol,4'-(1,2-diethyl-1,2-ethenediyl)bis-, (E)-, 4,4'-(1,2-DIETHYL-1,2-ETHENEDIYL)BIS-PHENOL, 4,4'-Stilbenediol, alpha,alpha'-diethyl-, (E)-(8CI), TRANS-4,4'-DIHYDROXY-ALPHA,BETA-DIETHYLSTILBENE, Z2568587997, 4,4'-STILBENEDIOL, ALPHA, ALPHA'-DIETHYL-, (E)-, Diethylstilbestrol, European Pharmacopoeia (EP) Reference Standard, Diethylstilbestrol, United States Pharmacopeia (USP) Reference Standard, 200-278-5, 678-392-3, InChI=1/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+
Topological Polar Surface Area 40.5
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 20.0
Description A steroid hormone that stimulates or controls the development and maintenance of female sex characteristics in mammals by binding to oestrogen receptors. The oestrogens are named for their importance in the oestrous cycle. (ChEBI). Estrogen is found in date and apricot.
Isotope Atom Count 0.0
Molecular Complexity 286.0
Database Name fooddb_chem_all;hmdb_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P21964, Q92731, P22309, P08684, P11712, P05181, P11511, P10632, P11509, P03372, P08183, Q9UNQ0, P0DMM9
Iupac Name 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
Nih Violation False
Class Stilbenes
Xlogp 5.1
Superclass Phenylpropanoids and polyketides
Is Pains False
Molecular Formula C18H20O2
Inchi Key RGLYKWWBQGJZGM-ISLYRVAYSA-N
Rotatable Bond Count 4.0
State Solid
Synonyms Estrogens, Oestrogen, Oestrogens, (e)-3,4-Bis(4-hydroxyphenyl)-3-hexene, (e)-4,4'-(1,2-Diethyl-1,2-ethenediyl)bisphenol, 4,4'-Dihydroxy-alpha,beta-diethylstilbene, alpha,Alpha'-diethyl-(e)-4,4'-stilbenediol, DES, Diethylstilbestrolum, Dietilestilbestrol, Distilbene, trans-4,4'-(1,2-Diethyl-1,2-ethenediyl)bisphenol, trans-Diethylstilbesterol, trans-Diethylstilbestrol, trans-Diethylstilboesterol, Stilbestrol, 4,4'-Dihydroxy-a,b-diethylstilbene, 4,4'-Dihydroxy-α,β-diethylstilbene, a,Alpha'-diethyl-(e)-4,4'-stilbenediol, Α,alpha'-diethyl-(e)-4,4'-stilbenediol, Agostilben, Apstil, Diethylstilbestrol, (Z)-isomer, Diethylstilbestrol, disodium salt, Distilbène, Estrogen, stilbene, Stilbene estrogen, Tampovagan, co Pharma brand OF diethylstilbestrol, Gerda brand OF diethylstilbestrol, APS brand OF diethylstilbestrol, CO-Pharma brand OF diethylstilbestrol, Diethylstilbesterol, Diethylstilbestrol BP, Diethylstilboesterol, Percutatrine oestrogenique iscovesco, Rcra waste number u089
Compound Name Diethylstilbestrol
Kingdom Organic compounds
Exact Mass 268.146
Formal Charge 0.0
Brenk Violation True
Monoisotopic Mass 268.146
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 268.3
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 1.0
Molecular Framework Aromatic homomonocyclic compounds
Inchi InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+
Smiles CC/C(=C(/CC)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O
Defined Bond Stereocenter Count 1.0
Taxonomy Direct Parent Stilbenes

  • 1. Outgoing r'ship FOUND_IN to/from Phoenix Dactylifera (Plant) Rel Props:Source_db:fooddb_chem_all
  • 2. Outgoing r'ship FOUND_IN to/from Prunus Armeniaca (Plant) Rel Props:Source_db:fooddb_chem_all
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