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MK-591 sodiumCas Number: 147030-01-1Formula: C34H34ClN2NaO3S Molecular Weight: 609.15IUPAC Name: sodium;3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoateSMILES: CC(C)(C)SC1=C(N(C2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CC=C(C=C5)Cl)CC(C)(C)C(=O)[O-].[Na+]InChIKey: YPURUCMVRRNPHJ-UHFFFAOYSA-MInChI: show more
Synonyms: 321US0I5R6 | sodium 3-[1-[(4-chlorophenyl)methyl]-5-(quinolin-2-ylmethoxy)-3-tert-butylsulfanyl-indol-2-yl]-2,2-dimet... -
3,4-Dihydroxybenzoic acidCas Number: 99-50-3 EC Number: 202-760-0Formula: C7H6O4 Molecular Weight: 154.12IUPAC Name: 3,4-dihydroxybenzoic acidSMILES: C1=CC(=C(C=C1C(=O)O)O)OInChIKey: YQUVCSBJEUQKSH-UHFFFAOYSA-NInChI: InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)Synonyms: AC-9617 | Carbohydroquinonic acid | DIHYDROXYBENZOIC ACID, 3,4- | Protocatechuic acid, primary pharmaceutical referen...
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Nordihydroguaiaretic AcidCas Number: 500-38-9Formula: C18H22O4 Molecular Weight: 302.37IUPAC Name: 4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diolSMILES: CC(CC1=CC(=C(C=C1)O)O)C(C)CC2=CC(=C(C=C2)O)OInChIKey: HCZKYJDFEPMADG-UHFFFAOYSA-NInChI: InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3Synonyms: NDGA | AC-24202 | HMS503G19 | Z2065671207 | 1, 4,4'-(2,3-dimethyl-1,4-butanediyl)bis- | KBio2_004917 | KBio3_002828 |...
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Methyl trans-p-CoumarateCas Number: 19367-38-5Formula: C10H10O3 Molecular Weight: 178.19IUPAC Name: methyl (E)-3-(4-hydroxyphenyl)prop-2-enoateSMILES: COC(=O)C=CC1=CC=C(C=C1)OInChIKey: NITWSHWHQAQBAW-QPJJXVBHSA-NInChI: InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3/b7-4+Synonyms: Cinnamic acid, p-hydroxy-, methyl ester (8CI) | Methyl Trans-P-Coumaric Acid | AG-690/03019022 | CHEBI:86904 | Methyl...
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PhenidoneCas Number: 92-43-3 EC Number: 202-155-1Formula: C9H10N2O Molecular Weight: 162.19IUPAC Name: 1-phenylpyrazolidin-3-oneSMILES: C1CN(NC1=O)C2=CC=CC=C2InChIKey: CMCWWLVWPDLCRM-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O/c12-9-6-7-11(10-9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)Synonyms: (phenidone)1-Phenyl-pyrazolidin-3-one | BDBM50009004 | CCG-207926 | SCHEMBL9670254 | WLN: T5NMVTJ AR | AKOS003264132 ...
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Isopropyl 4-hydroxybenzoateCas Number: 4191-73-5Formula: C10H12O3 Molecular Weight: 180.2IUPAC Name: propan-2-yl 4-hydroxybenzoateSMILES: CC(C)OC(=O)C1=CC=C(C=C1)OInChIKey: CMHMMKSPYOOVGI-UHFFFAOYSA-NInChI: InChI=1S/C10H12O3/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7,11H,1-2H3Synonyms: p-Oxybenzoesaureisopropylester | Z53833637 | FT-0627478 | Benzoic acid, 4-hydroxy-, 1-methylethyl ester | A6EOX47QK0 ...
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SaccharinCas Number: 81-07-2 EC Number: 201-321-0, 228-971-8 Compound CID: 5143Formula: C7H5NO3S Molecular Weight: 183.18IUPAC Name: 1,1-dioxo-1,2-benzothiazol-3-oneSMILES: C1=CC=C2C(=C1)C(=O)NS2(=O)=OInChIKey: CVHZOJJKTDOEJC-UHFFFAOYSA-NInChI: InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)Synonyms: AI3-38107 | 1,1-Dioxide-1,2-benzisothiazolin-3-one | HSDB 669 | 1,2-Dihydro-2-ketobenzisosulphonazole | Benzosulfinid...
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L-655,238Cas Number: 101910-24-1Formula: C22H25NO2 Molecular Weight: 335.44IUPAC Name: 1-[3-(quinolin-2-ylmethoxy)phenyl]hexan-1-olSMILES: CCCCCC(C1=CC(=CC=C1)OCC2=NC3=CC=CC=C3C=C2)OInChIKey: JRLOEMCOOZSCQP-UHFFFAOYSA-NInChI: InChI=1S/C22H25NO2/c1-2-3-4-12-22(24)18-9-7-10-20(15-18)25-16-19-14-13-17-8-5-6-11-21(17)23-19/h5-11,13-15,22,24H,2-4,12,16H2,1H3Synonyms: Benzenemethanol, alpha-pentyl-3-(2-quinolinylmethoxy)- | CHEBI:91821 | 1-[3-(Quinolin-2-ylmethoxy)-phenyl]-hexan-1-ol...
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PhenoxazineCas Number: 135-67-1Formula: C12H9NO Molecular Weight: 183.21IUPAC Name: 10H-phenoxazineSMILES: C1=CC=C2C(=C1)NC3=CC=CC=C3O2InChIKey: TZMSYXZUNZXBOL-UHFFFAOYSA-NInChI: InChI=1S/C12H9NO/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-8,13HSynonyms: EN300-218834 | 2,3;5,6-Dibenzo-1,4-oxazine | AM20020419 | PHENOXAZINE [MI] | Q731009 | EINECS 205-210-8 | Phenazoxine...
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SaccharinCas Number: 81-07-2 EC Number: 201-321-0, 228-971-8 Compound CID: 5143Formula: C7H5NO3S Molecular Weight: 183.18IUPAC Name: 1,1-dioxo-1,2-benzothiazol-3-oneSMILES: C1=CC=C2C(=C1)C(=O)NS2(=O)=OInChIKey: CVHZOJJKTDOEJC-UHFFFAOYSA-NInChI: InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)Synonyms: AI3-38107 | 1,1-Dioxide-1,2-benzisothiazolin-3-one | HSDB 669 | 1,2-Dihydro-2-ketobenzisosulphonazole | Benzosulfinid...
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Methyl 2,4-dihydroxybenzoateCas Number: 2150-47-2 EC Number: MFCD00002276Formula: C8H8O4 Molecular Weight: 168.15IUPAC Name: methyl 2,4-dihydroxybenzoateSMILES: COC(=O)C1=C(C=C(C=C1)O)OInChIKey: IIFCLXHRIYTHPV-UHFFFAOYSA-NInChI: InChI=1S/C8H8O4/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4,9-10H,1H3Synonyms: methyl 2,4 dihydroxybenzoate | MFCD00002276 | SCHEMBL382883 | beta-Resorcylic Acid Methyl Ester | Methyl 4-hydroxysal...
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Methyl 2,6-dihydroxybenzoateCas Number: 2150-45-0 EC Number: 624-891-6Formula: (HO)2C6H3CO2CH3 Molecular Weight: 168.15IUPAC Name: methyl 2,6-dihydroxybenzoateSMILES: COC(=O)C1=C(C=CC=C1O)OInChIKey: WCQZCKUNZVMBDC-UHFFFAOYSA-NInChI: InChI=1S/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H3Synonyms: 2,6-Dihydroxybenzoic acid, methyl ester | DTXSID40334174 | Benzoic acid, 2,6-dihydroxy-, methyl ester | D1461 | J-014...
