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HBV
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Isochlorogenic acid A, Channel blocker of TRPV3Cas Number: 2450-53-5Formula: C25H24O12 Molecular Weight: 516.45IUPAC Name: (3R,5R)-3,5-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,4-dihydroxycyclohexane-1-carboxylic acidSMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)OInChIKey: KRZBCHWVBQOTNZ-RDJMKVHDSA-NInChI: show moreSynonyms: 4-fluoro-phenyl-acetonitrile | AKOS032948323 | 3,5-dicaffeoyl quinic acid | 4-Fluorobenzaldhyde | A877898 | NCGC00390...
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(S)-TenofovirCas Number: 147127-19-3 Compound CID: 122767Formula: C9H14N5O4P Molecular Weight: 287.21IUPAC Name: [(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acidSMILES: CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)OInChIKey: SGOIRFVFHAKUTI-LURJTMIESA-NInChI: InChI=1S/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1Synonyms: (S)-9-(2-Phosphonylmethoxypropyl)adenine | MFCD21604708 | (S)-TDF | CS-0111892 | SCHEMBL2040329 | AKOS016844118 | ({[...
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CatalpolCas Number: 2415-24-9 EC Number: 219-324-0Formula: C15H22O10 Molecular Weight: 362.33IUPAC Name: show moreSMILES: C1=COC(C2C1C(C3C2(O3)CO)O)OC4C(C(C(C(O4)CO)O)O)OInChIKey: LHDWRKICQLTVDL-PZYDOOQISA-NInChI: show moreSynonyms: Catalpol | CHEBI:69797 | SR-05000002315-2 | (2S,3R,4S,5S,6R)-2-[[(1S,2S,4S,5S,6R,10S)-5-hydroxy-2-(hydroxymethyl)-3,9...
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NicotinamideCas Number: 98-92-0 EC Number: 202-713-4Formula: C6H6N2O Molecular Weight: 122.12IUPAC Name: pyridine-3-carboxamideSMILES: C1=CC(=CN=C1)C(=O)NInChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)Synonyms: 3-Pyridinecarboxylic acid amide | Delonin amide | niacinamide | Nicofort | vitamin PP | .beta.-Pyridinecarboxamide | ...
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NicotinamideCas Number: 98-92-0 EC Number: 202-713-4Formula: C6H6N2O Molecular Weight: 122.12IUPAC Name: pyridine-3-carboxamideSMILES: C1=CC(=CN=C1)C(=O)NInChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)Synonyms: 3-Pyridinecarboxylic acid amide | Delonin amide | niacinamide | Nicofort | vitamin PP | .beta.-Pyridinecarboxamide | ...
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NicotinamideCas Number: 98-92-0 EC Number: 202-713-4Formula: C6H6N2O Molecular Weight: 122.12IUPAC Name: pyridine-3-carboxamideSMILES: C1=CC(=CN=C1)C(=O)NInChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)Synonyms: 3-Pyridinecarboxylic acid amide | Delonin amide | niacinamide | Nicofort | vitamin PP | .beta.-Pyridinecarboxamide | ...
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OstholeCas Number: 484-12-8 EC Number: 610-421-7Formula: C15H16O3 Molecular Weight: 244.29IUPAC Name: 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-oneSMILES: CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)CInChIKey: MBRLOUHOWLUMFF-UHFFFAOYSA-NInChI: InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3Synonyms: KBioSS_002022 | NSC 31868 | SDCCGMLS-0066780.P001 | 7-methoxy-8-(3-methylpent-2-enyl)coumarin | A827530 | KBio3_00258...
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Adriamycin, Inhibitor of DNA topoisomerase II alphaCas Number: 23214-92-8 Compound CID: 31703Formula: C27H29NO11 Molecular Weight: 543.5IUPAC Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dioneSMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)OInChIKey: AOJJSUZBOXZQNB-TZSSRYMLSA-NInChI: show moreSynonyms: Adriablastin | hydroxydaunomycin | Hydroxyldaunorubicin | LMPK13050001 | NCI-C01514 | Doxorubicine | NSC-759155 | D03...
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BicyclolCas Number: 118159-48-1Formula: C19H18O9 Molecular Weight: 390.34IUPAC Name: methyl 4-[5-(hydroxymethyl)-7-methoxy-1,3-benzodioxol-4-yl]-7-methoxy-1,3-benzodioxole-5-carboxylateSMILES: COC1=C2C(=C(C(=C1)CO)C3=C4C(=C(C=C3C(=O)OC)OC)OCO4)OCO2InChIKey: KXMTXZACPVCDMH-UHFFFAOYSA-NInChI: InChI=1S/C19H18O9/c1-22-11-4-9(6-20)13(17-15(11)25-7-27-17)14-10(19(21)24-3)5-12(23-2)16-18(14)28-8-26-16/h4-5,20H,6-8H2,1-3H3Synonyms: 4,4'-Bi-1,3-benzodioxole)-5-carboxylic acid, 5'-(hydroxymethyl)-7,7'-dimethoxy-, methyl ester | 5'-(hydroxymethyl)-7,...
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Tetrahydropyran-4-methanolCas Number: 14774-37-9 Compound CID: 2773573Formula: C6H12O2 Molecular Weight: 116.16IUPAC Name: oxan-4-ylmethanolSMILES: C1COCCC1COInChIKey: YSNVSVCWTBLLRW-UHFFFAOYSA-NInChI: InChI=1S/C6H12O2/c7-5-6-1-3-8-4-2-6/h6-7H,1-5H2Synonyms: 4-HYDROXYMETHYLTETRAHYDROPYRAN | J-650330 | W-205668 | PS-3348 | SCHEMBL104405 | 4-(hydroxylmethyl)tetrahydro-2H-pyra...
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Tenofovir disoproxilCas Number: 201341-05-1 Compound CID: 5481350Formula: C19H30N5O10P Molecular Weight: 519.44IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonateSMILES: CC(C)OC(=O)OCOP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OCOC(=O)OC(C)CInChIKey: JFVZFKDSXNQEJW-CQSZACIVSA-NInChI: show moreSynonyms: (R)-(((((1-(6-Amino-9H-purin-9-yl)propan-2-yl)oxy)methyl)phosphoryl)bis(oxy))bis(methylene) diisopropyl dicarbonate |...
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Adefovir, DNA polymerase/reverse transcriptase inhibitorCas Number: 106941-25-7Formula: C8H12N5O4P Molecular Weight: 273.19IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethylphosphonic acidSMILES: C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)NInChIKey: SUPKOOSCJHTBAH-UHFFFAOYSA-NInChI: InChI=1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)Synonyms: Phosphonic acid, ((2-6-amino-9H-purin-9-YL)ethoxy)methyl | ADEFOVIR [WHO-DD] | DB13868 | ((2-6-amino-9H-purin-9-yl) e...

