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Rofecoxib, Cyclooxygenase-2 inhibitorCas Number: 162011-90-7 Compound CID: 5090Formula: C17H14O4S Molecular Weight: 314.36IUPAC Name: 3-(4-methylsulfonylphenyl)-4-phenyl-2H-furan-5-oneSMILES: CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2)C3=CC=CC=C3InChIKey: RZJQGNCSTQAWON-UHFFFAOYSA-NInChI: InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3Synonyms: HMS2093E04 | MK966 | MK-966 | SB19518 | HMS1922H11 | KBioSS_000559 | STK635144 | SCHEMBL3050 | cMAP_000024 | KBio2_00...
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Ginsenoside Rg3Cas Number: 14197-60-5Formula: C42H72O13 Molecular Weight: 785.01IUPAC Name: show moreSMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)O)CInChIKey: RWXIFXNRCLMQCD-JBVRGBGGSA-NInChI: show moreSynonyms: ginsenoside rg3, (s)- | Ginsenoside Rg3, >=98% (HPLC) | s9022 | 20(S)-Propanaxidiol | Soledon Dark Brown 3R | CCG-270...
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Ginsenoside RdCas Number: 52705-93-8 Compound CID: 11679800Formula: C48H82O18 Molecular Weight: 947.15IUPAC Name: show moreSMILES: CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)OC7C(C(C(C(O7)CO)O)O)O)CInChIKey: RLDVZILFNVRJTL-IWFVLDDISA-NInChI: show moreSynonyms: .BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,12.BETA.)-20-(.BETA.-D-GLUCOPYRANOSYLOXY)-12-HYDROXYDAMMAR-24-EN-3-YL 2-O-.BETA.-D...
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Salicylic acid, Channel blocker of ASIC3Formula: C7H6O3 Molecular Weight: 138.12IUPAC Name: 2-hydroxybenzoic acidSMILES: C1=CC=C(C(=C1)C(=O)O)OInChIKey: YGSDEFSMJLZEOE-UHFFFAOYSA-NInChI: InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)Synonyms: DHS Sal Shampoo | Domerine | DTXSID7026368 | Salicylic acid (TN) | 2-Carboxyphenol | Duofil wart remover | Durasal | ...
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MacelignanCas Number: 107534-93-0Formula: C20H24O4 Molecular Weight: 328.4IUPAC Name: 4-[(2S,3R)-4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenolSMILES: CC(CC1=CC2=C(C=C1)OCO2)C(C)CC3=CC(=C(C=C3)O)OCInChIKey: QDDILOVMGWUNGD-UONOGXRCSA-NInChI: InChI=1S/C20H24O4/c1-13(8-15-4-6-17(21)19(10-15)22-3)14(2)9-16-5-7-18-20(11-16)24-12-23-18/h4-7,10-11,13-14,21H,8-9,12H2,1-3H3/t13-,14+/m0/s1Synonyms: (+)-Anwulignan;Anwuligan | AKOS037645016 | (+)-Anwulignan | 4-((2S,3R)-4-(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutyl...
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6-HydroxyflavanoneCas Number: 4250-77-5Formula: C15H12O3 Molecular Weight: 240.26IUPAC Name: 6-hydroxy-2-phenyl-2,3-dihydrochromen-4-oneSMILES: C1C(OC2=C(C1=O)C=C(C=C2)O)C3=CC=CC=C3InChIKey: XYHWPQUEOOBIOW-UHFFFAOYSA-NInChI: InChI=1S/C15H12O3/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15-16H,9H2Synonyms: A872871 | 6-hydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one | IDI1_011957 | Maybridge3_000570 | DTXSID1022429 | In...
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D(-)-Salicin, Agonist of TAS2R16Formula: C13H18O7 Molecular Weight: 286.28IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triolSMILES: C1=CC=C(C(=C1)CO)OC2C(C(C(C(O2)CO)O)O)OInChIKey: NGFMICBWJRZIBI-UJPOAAIJSA-NInChI: InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1Synonyms: D-Salicin, United States Pharmacopeia (USP) Reference Standard | Spectrum4_001058 | 4649620TBZ | Benzyl alcohol, o-hy...
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Mefenamic Acid, Cyclooxygenase inhibitorCas Number: 61-68-7Formula: C15H15NO2 Molecular Weight: 241.29IUPAC Name: 2-(2,3-dimethylanilino)benzoic acidSMILES: CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)CInChIKey: HYYBABOKPJLUIN-UHFFFAOYSA-NInChI: InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)Synonyms: Acidum mefenamicum | EINECS 200-513-1 | MLS000069709 | 2-[(2,3-dimethylphenyl)amino]benzoic acid | Mefenacid | MEFENA...
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MelamineCas Number: 108-78-1 EC Number: 203-615-4Formula: C3H6N6 Molecular Weight: 126.12IUPAC Name: 1,3,5-triazine-2,4,6-triamineSMILES: C1(=NC(=NC(=N1)N)N)NInChIKey: JDSHMPZPIAZGSV-UHFFFAOYSA-NInChI: InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)Synonyms: CCG-266105 | MELAMINE (IARC) | Melamine; 1,3,5-Triazine-2,4,6-triamine | STK378738 | 2,6-Triamino-1,3,5-triazine | s-...
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Carprofen, Cyclooxygenase-2 inhibitorCas Number: 53716-49-7Formula: C15H12ClNO2 Molecular Weight: 273.72IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acidSMILES: CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)OInChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-NInChI: InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)Synonyms: (S)-alpha-Methyl-6-chloro-9H-carbazole-2-acetic acid | 9H-Carbazole-2-acetic acid, 6-chloro-.alpha.-methyl- | Rimadyl...
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GuaiacolCas Number: 90-05-1 EC Number: 201-964-7Formula: C7H8O2 Molecular Weight: 124.14IUPAC Name: 2-methoxyphenolSMILES: COC1=CC=CC=C1OInChIKey: LHGVFZTZFXWLCP-UHFFFAOYSA-NInChI: InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3Synonyms: o-Hydroxyanisole | Creasote | orthomethoxyphenol | ortho-methoxyphenol | MLS001055375 | NCGC00090827-04 | 3-methoxy-4...
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Indometacin FarnesilCas Number: 85801-02-1 Compound CID: 5282183Formula: C34H40ClNO4 Molecular Weight: 562.15IUPAC Name: [(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl] 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetateSMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC=C(C)CCC=C(C)CCC=C(C)CInChIKey: CFIGYZZVJNJVDQ-LMJOQDENSA-NInChI: show moreSynonyms: indometacin-farnesil | INDOMETACIN FARNECYL ESTER [WHO-DD] | Indometacin farnesil [JAN] | CAS-85801-02-1 | Indometaci...
