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  1. Tamoxifen, Agonist of Estrogen receptor-α;Antagonist of Estrogen receptor-α;Agonist of Estrogen receptor-β;Antagonist of Estrogen receptor-β;Agonist of GPER
    Cas#: 10540-29-1       
    Formula:  C26H29NO        Molecular Weight: 371.51
    IUPAC Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
    SMILES: CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3
    InChIKey: NKANXQFJJICGDU-QPLCGJKRSA-N
    InChI: 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
  2. Tiliroside
    Cas#: 20316-62-5        Compound CID:  5320686
    Formula:  C30H26O13        Molecular Weight: 594.52
    IUPAC Name: [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
    SMILES: C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O
    InChIKey: DVGGLGXQSFURLP-VWMSDXGPSA-N
    InChI: InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+/t21-,24-,26+,27-,30+/m1/s1
    Synonyms: HSDB 593 | 2-PROPENOIC ACID, 3-(4-HYDROXYPHENYL)-, 6'-ESTER WITH 3-(.BETA.-D-GLUCOPYRANOSYLOXY)-5,7-DIHYDROXY-2-(4-HY...
  3. Climbazol
    Cas#: 38083-17-9        Compound CID:  37907
    Formula:  C15H17ClN2O2        Molecular Weight: 292.76
    IUPAC Name: 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one
    SMILES: CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl
    InChIKey: OWEGWHBOCFMBLP-UHFFFAOYSA-N
    InChI: InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3
    Synonyms: 1-(4-Chlorophenoxy)-3,3-dimethyl-1-(imidazole-1-yl)-2-butanone | 1-(4-Chlorophenoxy)-1-(imidazol-1-yl)-3,3-dimethylbu...
  4. Resveratrol, Inhibitor of COX-2;Agonist of TAS2R14;Antagonist of Peroxisome proliferator-activated receptor-γ
    Cas#: 501-36-0        Compound CID:  445154
    Formula:  C14H12O3        Molecular Weight: 228.24
    IUPAC Name: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
    SMILES: C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
    InChIKey: LUKBXSAWLPMMSZ-OWOJBTEDSA-N
    InChI: InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
    Synonyms: Q369O8926L | CHEBI:27881 | CU-01000001503-3 | HMS1792H15 | NSC133100 | BPBio1_000479 | NCGC00344093-09 | RESVERATROL ...
  5. Triptolide
    Cas#: 38748-32-2        Compound CID:  107985
    Formula:  C20H24O6        Molecular Weight: 360.4
    IUPAC Name: (1S,2S,4S,5S,7R,8R,9S,11S,13S)-8-hydroxy-1-methyl-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-17-one
    SMILES: CC(C)C12C(O1)C3C4(O3)C5(CCC6=C(C5CC7C4(C2O)O7)COC6=O)C
    InChIKey: DFBIRQPKNDILPW-CIVMWXNOSA-N
    InChI: InChI=1S/C20H24O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14,16,22H,4-7H2,1-3H3/t11-,12-,13-,14-,16+,17-,18-,19+,20+/m0/s1
    Synonyms: HY-32735 | NSC839303 | NSC-839303 | CAS-5611-51-8 | SCHEMBL413634 | MLS000759410 | NCGC00163411-02 | BSPBio_001595 | ...
  6. Schisantherin A
    Cas#: 58546-56-8        Compound CID:  151529
    Formula:  C30H32O9        Molecular Weight: 536.57
    IUPAC Name: [(8S,9S,10S)-9-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-8-yl] benzoate
    SMILES: CC1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4C(C1(C)O)OC(=O)C5=CC=CC=C5)OC)OC)OC)OC)OCO3
    InChIKey: UFCGDBKFOKKVAC-DSASHONVSA-N
    InChI: InChI=1S/C30H32O9/c1-16-12-18-13-21-25(38-15-37-21)26(35-5)22(18)23-19(14-20(33-3)24(34-4)27(23)36-6)28(30(16,2)32)39-29(31)17-10-8-7-9-11-17/h7-11,13-14,16,28,32H,12,15H2,1-6H3/t16-,28-,30-/m0/s1
    Synonyms: MFCD09026937 | NCI60_003686 | SCHISANTHERIN A (GOMISIN C) (CONSTITUENT OF NORTHERN SCHISANDRA) [DSC] | WLN: QY5&1 | S...
  7. Rutaecarpine
    Cas#: 84-26-4        Compound CID:  65752
    Formula:  C18H13N3O        Molecular Weight: 287.32
    IUPAC Name: 3,13,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2(10),4,6,8,15,17,19-octaen-14-one
    SMILES: C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=CC=CC=C5N4
    InChIKey: ACVGWSKVRYFWRP-UHFFFAOYSA-N
    InChI: InChI=1S/C18H13N3O/c22-18-13-6-2-4-8-15(13)20-17-16-12(9-10-21(17)18)11-5-1-3-7-14(11)19-16/h1-8,19H,9-10H2
    Synonyms: C18H13N3O | SMR001230721 | RUTECARPINE [MI] | Indolo[2',4]pyrido[2,1-b]quinazolin-5(7H)-one, 8,13-dihydro- | Rutaecar...
  8. Citrate, Activator of TRPP2;Activator of TRPV4
    Cas#: 77-92-9        Compound CID:  311
    Formula:  C6H8O7        Molecular Weight: 192.12
    IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid
    SMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)O
    InChIKey: KRKNYBCHXYNGOX-UHFFFAOYSA-N
    InChI: InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
    Synonyms: Citric acid monoglyceride | Citric acid, 99% | ANHYDROUS CITRIC ACID COMPONENT OF CLENPIQ | HSDB 911 | NCIOpen2_00450...
  9. Hexachlorophene, Bacterial enoyl-[acyl-carrier-protein] reductase inhibitor
    Cas#: 70-30-4        Compound CID:  3598
    Formula:  CH2[C6H(Cl)3OH]2        Molecular Weight: 406.9
    IUPAC Name: 3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxyphenyl)methyl]phenol
    SMILES: C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl
    InChIKey: ACGUYXCXAPNIKK-UHFFFAOYSA-N
    InChI: 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,1H2
    Synonyms: 2,2'-methanediylbis(3,4,6-trichlorophenol) | hexachlorophene | IWW5FV6NK2 | 2,5,6-trichlorophenol) | 6,6'-Methylenebi...
  10. Phenothiazine
    Cas#: 92-84-2        Compound CID:  7108
    Formula:  C12H9NS        Molecular Weight: 199.27
    IUPAC Name: 10H-phenothiazine
    SMILES: C1=CC=C2C(=C1)NC3=CC=CC=C3S2
    InChIKey: WJFKNYWRSNBZNX-UHFFFAOYSA-N
    InChI: InChI=1S/C12H9NS/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-8,13H
    Synonyms: PTZ | ENT-38 | phenothiazin | Souframine | Fenotiazina [Italian] | Dibenzothiazine | ALIMEMAZINE HEMITARTRATE IMPURIT...
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