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Chemical synthesis
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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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Potassium AmylxanthateCas Number: 2720-73-2 Compound CID: 493949Formula: C6H11KOS2 Molecular Weight: 202.37IUPAC Name: potassium;pentoxymethanedithioateSMILES: CCCCCOC(=S)[S-].[K+]InChIKey: YIBBMDDEXKBIAM-UHFFFAOYSA-MInChI: InChI=1S/C6H12OS2.K/c1-2-3-4-5-7-6(8)9;/h2-5H2,1H3,(H,8,9);/q;+1/p-1Synonyms: Potassium O-Amyl Dithiocarbonate | CS-0152131 | Carbonodithioic acid, O-pentyl ester, potassium salt | N-Amylxanthic ...
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Potassium IsopropylxanthateCas Number: 140-92-1 Compound CID: 10931938Formula: C4H7KOS2 Molecular Weight: 174.32IUPAC Name: potassium;propan-2-yloxymethanedithioateSMILES: CC(C)OC(=S)[S-].[K+]InChIKey: ZMWBGRXFDPJFGC-UHFFFAOYSA-MInChI: InChI=1S/C4H8OS2.K/c1-3(2)5-4(6)7;/h3H,1-2H3,(H,6,7);/q;+1/p-1Synonyms: PB30805 | J-007432 | potassium O-isopropyl carbonodithioate | BDBM50004939 | Proxan-potassium | UNII-CF12586ULS | MFC...
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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...
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Methyl 3,5-dihydroxybenzoateCas Number: 2150-44-9 EC Number: 218-426-2Formula: (HO)2C6H3CO2CH3 Molecular Weight: 168.15IUPAC Name: methyl 3,5-dihydroxybenzoateSMILES: COC(=O)C1=CC(=CC(=C1)O)OInChIKey: RNVFYQUEEMZKLR-UHFFFAOYSA-NInChI: InChI=1S/C8H8O4/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2-4,9-10H,1H3Synonyms: AMY30290 | Z104487920 | AN-651/43112578 | cinc | EINECS 218-426-2 | Methyl 3,5-hydroxybenzoate | BDBM50428392 | Lead ...
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Methyl 3,4-DihydroxybenzoateCas Number: 2150-43-8Formula: C8H8O4 Molecular Weight: 168.15IUPAC Name: methyl 3,4-dihydroxybenzoateSMILES: COC(=O)C1=CC(=C(C=C1)O)OInChIKey: CUFLZUDASVUNOE-UHFFFAOYSA-NInChI: InChI=1S/C8H8O4/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,9-10H,1H3Synonyms: 3,4-Dihydroxybenzoic Acid Methyl Ester | Methyl protocatechuate | Protocatechuic Acid Methyl Ester
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Methyl 4-hydroxybenzoateCas Number: 99-76-3 EC Number: 243-171-5Formula: C8H8O3 Molecular Weight: 152.15IUPAC Name: methyl 4-hydroxybenzoateSMILES: COC(=O)C1=CC=C(C=C1)OInChIKey: LXCFILQKKLGQFO-UHFFFAOYSA-NInChI: InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3Synonyms: Methyl 4-hydroxybenzoate | METHYLPARABEN | Methyl p-hydroxybenzoate | Methyl paraben | Nipagin | Methyl parahydroxybe...
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7-HydroxycoumarinCas Number: 93-35-6 EC Number: 202-240-3Formula: C9H6O3 Molecular Weight: 162.14IUPAC Name: 7-hydroxychromen-2-oneSMILES: C1=CC(=CC2=C1C=CC(=O)O2)OInChIKey: ORHBXUUXSCNDEV-UHFFFAOYSA-NInChI: InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10HSynonyms: CCG-39436 | Dichrin A | FT-0621430 | MEGxp0_000814 | NCI60_001646 | SDCCGMLS-0066941.P001 | UMBELLIFERONE [MI] | Z571...
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Potassium ethyl xanthogenateCas Number: 140-89-6 EC Number: 205-439-3Formula: C3H5KOS2 Molecular Weight: 160.3IUPAC Name: potassium;ethoxymethanedithioateSMILES: CCOC(=S)[S-].[K+]InChIKey: JCBJVAJGLKENNC-UHFFFAOYSA-MInChI: InChI=1S/C3H6OS2.K/c1-2-4-3(5)6;/h2H2,1H3,(H,5,6);/q;+1/p-1Synonyms: C3H5KOS2 | EC 205-439-3 | Kaliumxanthogenat | Potassium ethyl xanthogenate, 97% | DTXCID4022315 | BDBM50004940 | etho...
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Saccharin, Agonist of TAS2R31;Agonist of TAS2R43Cas 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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4-HydroxybenzenesulfonamideCas Number: 1576-43-8Formula: C6H7NO3S Molecular Weight: 173.19IUPAC Name: 4-hydroxybenzenesulfonamideSMILES: C1=CC(=CC=C1O)S(=O)(=O)NInChIKey: DIRCLGLKRZLKHG-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-5(8)2-4-6/h1-4,8H,(H2,7,9,10)Synonyms: Benzenesulfonamide, 4-hydroxy- | BP-10587 | SY045622 | p-Hydroxy-benzene derivative, 3a | 1IIT7R7VPJ | 4-Hydroxybenze...
