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Bisphenol A, Antagonist of Androgen receptor;Agonist of Estrogen receptor-βCas#: 80-05-7 Compound CID: 6623Formula: C15H16O2 Molecular Weight: 228.29IUPAC Name: 4-[2-(4-hydroxyphenyl)propan-2-yl]phenolSMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OInChIKey: IISBACLAFKSPIT-UHFFFAOYSA-NInChI: InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3Synonyms: Bis(4-hydroxyphenyl) dimethylmethane | bis-phenol-a | Bisphenol-A | DTXCID30182 | 4,2-propane | 4,4'-Dihydroxdiphenyl...
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Tamoxifen, Agonist of Estrogen receptor-α;Antagonist of Estrogen receptor-α;Agonist of Estrogen receptor-β;Antagonist of Estrogen receptor-β;Agonist of GPERCas#: 10540-29-1Formula: C26H29NO Molecular Weight: 371.51IUPAC Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamineSMILES: CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3InChIKey: NKANXQFJJICGDU-QPLCGJKRSA-NInChI: InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-Synonyms: (Z)-Tamoxifen | ICI 47699 | trans-Tamoxifen
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Genistein, Activator of CFTR;Agonist of Estrogen receptor-β;Agonist of Estrogen-related receptor-α;Agonist of Estrogen-related receptor-β;Agonist of Estrogen-related receptor-γ;Agonist of TAS2R14;Agonist of TAS2R39;Activator of TRPC5Cas#: 446-72-0 Compound CID: 5280961Formula: C15H10O5 Molecular Weight: 270.24IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-oneSMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)OInChIKey: TZBJGXHYKVUXJN-UHFFFAOYSA-NInChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18HSynonyms: cid_5280961 | GTPL2826 | BRN 0263823 | DH2M523P0H | MolMap_000022 | GENISTEIN (USP-RS) | Differenol A | GENISTEIN [MI...
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Oleic acidCas#: 112-80-1 Compound CID: 445639Formula: CH3(CH2)7CH=CH(CH2)7COOH Molecular Weight: 282.46IUPAC Name: (Z)-octadec-9-enoic acidSMILES: CCCCCCCCC=CCCCCCCCC(=O)OInChIKey: ZQPPMHVWECSIRJ-KTKRTIGZSA-NInChI: InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-Synonyms: C18:1 | HSDB 1240 | Elainic acid | Pamolyn | Priolene 6936 | K 52 | Emersol 220 white oleic acid | OLEICACID | UNII-2...
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GenisteinCas#: 446-72-0 Compound CID: 5280961Formula: C15H10O5 Molecular Weight: 270.24IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-oneSMILES: C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)OInChIKey: TZBJGXHYKVUXJN-UHFFFAOYSA-NInChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18HSynonyms: cid_5280961 | GTPL2826 | BRN 0263823 | DH2M523P0H | MolMap_000022 | GENISTEIN (USP-RS) | Differenol A | GENISTEIN [MI...
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Butyric acid, Agonist of FFA2 receptor;Agonist of FFA3 receptor;Agonist of HCA 2 receptor;Inhibitor of histone deacetylase 1;Inhibitor of histone deacetylase 2;Inhibitor of histone deacetylase 3;Inhibitor of histone deacetylase 8Cas#: 107-92-6 Compound CID: 264Formula: C4H8O2 Molecular Weight: 88.11IUPAC Name: butanoic acidSMILES: CCCC(=O)OInChIKey: FERIUCNNQQJTOY-UHFFFAOYSA-NInChI: InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)Synonyms: butyric acid|butanoic acid|107-92-6|n-Butyric acid|n-Butanoic acid|propylformic acid|ethylacetic acid|1-propanecarbox...
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Hexachlorophene, Bacterial enoyl-[acyl-carrier-protein] reductase inhibitorCas#: 70-30-4 Compound CID: 3598Formula: CH2[C6H(Cl)3OH]2 Molecular Weight: 406.9IUPAC Name: 3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxyphenyl)methyl]phenolSMILES: C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)ClInChIKey: ACGUYXCXAPNIKK-UHFFFAOYSA-NInChI: InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2Synonyms: 2,2'-methanediylbis(3,4,6-trichlorophenol) | hexachlorophene | IWW5FV6NK2 | 2,5,6-trichlorophenol) | 6,6'-Methylenebi...
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Bisphenol ACas#: 80-05-7 Compound CID: 6623Formula: C15H16O2 Molecular Weight: 228.29IUPAC Name: 4-[2-(4-hydroxyphenyl)propan-2-yl]phenolSMILES: CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OInChIKey: IISBACLAFKSPIT-UHFFFAOYSA-NInChI: InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3Synonyms: Bisphenol A|80-05-7|2,2-Bis(4-hydroxyphenyl)propane|4,4'-Isopropylidenediphenol|Diphenylolpropane|4,4'-Bisphenol A|Bi...
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Butyric acidCas#: 107-92-6 Compound CID: 264Formula: C4H8O2 Molecular Weight: 88.11IUPAC Name: butanoic acidSMILES: CCCC(=O)OInChIKey: FERIUCNNQQJTOY-UHFFFAOYSA-NInChI: InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)Synonyms: butyric acid|butanoic acid|107-92-6|n-Butyric acid|n-Butanoic acid|propylformic acid|ethylacetic acid|1-propanecarbox...
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Estriol, Estrogen receptor modulatorCas#: 50-27-1 Compound CID: 5756Formula: C18H24O3 Molecular Weight: 288.38IUPAC Name: (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triolSMILES: CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)OInChIKey: PROQIPRRNZUXQM-ZXXIGWHRSA-NInChI: InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1Synonyms: A 13610 | Chlorapatite | Estriol, unconjugated | Overstin | Tridestrin | Estriel (TN) | ESTRIOL [MART.] | Estriol [US...
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Estrone, Estrogen receptor alpha agonistCas#: 53-16-7 Compound CID: 5870Formula: C18H22O2 Molecular Weight: 270.37IUPAC Name: (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-oneSMILES: CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OInChIKey: DNXHEGUUPJUMQT-CBZIJGRNSA-NInChI: InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1Synonyms: 2DI9HA706A | Cristallovar | delta-1,3,5-estratrien-3-beta-ol-17-one | delta-1,3,5-Estratrien-3beta-ol-17-one | ESTRON...
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Oleic acidCas#: 112-80-1 Compound CID: 445639Formula: CH3(CH2)7CH=CH(CH2)7COOH Molecular Weight: 282.46IUPAC Name: (Z)-octadec-9-enoic acidSMILES: CCCCCCCCC=CCCCCCCCC(=O)OInChIKey: ZQPPMHVWECSIRJ-KTKRTIGZSA-NInChI: InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-Synonyms: oleic acid|112-80-1|cis-9-Octadecenoic acid|oleate|Elaidoic acid|cis-Oleic acid|Wecoline OO|Vopcolene 27|Glycon wo|(Z...