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Keap1-Nrf2
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DendrobineCas Number: 2115-91-5Formula: C16H25NO2 Molecular Weight: 263.37IUPAC Name: (1S,4S,7S,8R,11R,12R,13S)-2,12-dimethyl-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-9-oneSMILES: CC(C)C1C2C3CCC4C3(C(C1OC2=O)N(C4)C)CInChIKey: RYAHJFGVOCZDEI-UFFNCVEVSA-NInChI: InChI=1S/C16H25NO2/c1-8(2)11-12-10-6-5-9-7-17(4)14(16(9,10)3)13(11)19-15(12)18/h8-14H,5-7H2,1-4H3/t9-,10+,11+,12-,13-,14-,16+/m1/s1Synonyms: HY-N0638 | CHEBI:4400 | AC-34706 | (1S,4S,7S,8R,11R,12R,13S)-2,12-Dimethyl-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4....
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Cryptochlorogenic acidCas Number: 905-99-7Formula: C16H18O9 Molecular Weight: 354.31IUPAC Name: (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylic acidSMILES: C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OInChIKey: GYFFKZTYYAFCTR-AVXJPILUSA-NInChI: show moreSynonyms: Cinnamic acid, 3,4-dihydroxy-, 4-carboxy-2,4,6-trihydroxycyclohexyl ester | Cyclohexanecarboxylic acid, 4-((3-(3,4-di...
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Sodium 3-(3,4-dihydroxyphenyl)-DL-lactateCas Number: 67920-52-9 Compound CID: 23711819Formula: C9H9NaO5 Molecular Weight: 220.15IUPAC Name: sodium;3-(3,4-dihydroxyphenyl)-2-hydroxypropanoateSMILES: C1=CC(=C(C=C1CC(C(=O)[O-])O)O)O.[Na+]InChIKey: ZMMKVDBZTXUHFO-UHFFFAOYSA-MInChI: InChI=1S/C9H10O5.Na/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14;/h1-3,8,10-12H,4H2,(H,13,14);/q;+1/p-1Synonyms: AKOS025401681 | CS-5678 | sodium;3-(3,4-dihydroxyphenyl)-2-hydroxypropanoate | ( inverted exclamation markA)-DanShenS...
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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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Dimethyl fumarateCas Number: 624-49-7 EC Number: 210-849-0Formula: C6H8O4 Molecular Weight: 144.13IUPAC Name: dimethyl (E)-but-2-enedioateSMILES: COC(=O)C=CC(=O)OCInChIKey: LDCRTTXIJACKKU-ONEGZZNKSA-NInChI: InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+Synonyms: Dimethylfumarate | BG-12 | (E)-Dimethyl fumarate | Boletic acid dimethyl ester | Methyl fumarate | Dimethyl (E)-but-2...
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6-(Methylsulfinyl)hexyl isothiocyanate (6-MITC)Cas Number: 4430-35-7Formula: C8H15NOS2 Molecular Weight: 205.34IUPAC Name: 1-isothiocyanato-6-methylsulfinylhexaneSMILES: CS(=O)CCCCCCN=C=SInChIKey: XQZVZULJKVALRI-UHFFFAOYSA-NInChI: InChI=1S/C8H15NOS2/c1-12(10)7-5-3-2-4-6-9-8-11/h2-7H2,1H3Synonyms: Hexane, 1-isothiocyanato-6-(methylsulfinyl)- | 6-(methylsulfinyl)hexyl isothiocyanate | Isothiocyanic acid, 6-(methyl...
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7-HydroxyflavoneCas Number: 6665-86-7Formula: C15H10O3 Molecular Weight: 238.24IUPAC Name: 7-hydroxy-2-phenylchromen-4-oneSMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)OInChIKey: MQGPSCMMNJKMHQ-UHFFFAOYSA-NInChI: InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16HSynonyms: NSC 94258 | 7-Hydroxy-2-phenyl-4H-chromen-4-one | NCGC00168801-01 | H0852 | MFCD00006835 | SY048832 | 7-Hydroxyflavon...
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Ezetimibe, Niemann-Pick C1-like protein 1 inhibitorCas Number: 163222-33-1 EC Number: 682-606-0Formula: C24H21F2NO3 Molecular Weight: 409.43IUPAC Name: (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-oneSMILES: C1=CC(=CC=C1C2C(C(=O)N2C3=CC=C(C=C3)F)CCC(C4=CC=C(C=C4)F)O)OInChIKey: OLNTVTPDXPETLC-XPWALMASSA-NInChI: show moreSynonyms: Zetia | Ezetrol | F0112 | NC00134 | Q18472686 | MLS000759443 | (3R,4S)-1-(4-fluorophenyl)-3-((S)-3-(4-fluorophenyl)-3...
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DL-SulforaphaneCas Number: 4478-93-7Formula: C6H11NOS2 Molecular Weight: 177.29IUPAC Name: 1-isothiocyanato-4-methylsulfinylbutaneSMILES: CS(=O)CCCCN=C=SInChIKey: SUVMJBTUFCVSAD-UHFFFAOYSA-NInChI: InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3Synonyms: AKOS006282481 | 4-Methylsulfinyl butyl isothiocyanate | Z1198151975 | BRD-A58955223-001-02-0 | 4-isothiocyanatobutyl ...
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Bardoxolone, kelch like ECH-associated protein 1;Agonist of Peroxisome proliferator-activated receptor-γCas Number: 218600-44-3Formula: C31H41NO4 Molecular Weight: 491.66IUPAC Name: (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylic acidSMILES: CC1(CCC2(CCC3(C(C2C1)C(=O)C=C4C3(CCC5C4(C=C(C(=O)C5(C)C)C#N)C)C)C)C(=O)O)CInChIKey: TXGZJQLMVSIZEI-UQMAOPSPSA-NInChI: show moreSynonyms: Bardoxolone (USAN/INN) | 2-cyano-3,12-dioxooleana-1,9(11)-dien-28-oic acid | AKOS032960362 | D09584 | BARDOXOLONE [MI...
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Bardoxolone Methyl(CDDO-Me), Antagonist of Peroxisome proliferator-activated receptor-γCas Number: 218600-53-4Formula: C32H43NO4 Molecular Weight: 505.69IUPAC Name: methyl (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,3,4,5,6,7,8,8a,14a,14b-decahydropicene-4a-carboxylateSMILES: CC1(CCC2(CCC3(C(C2C1)C(=O)C=C4C3(CCC5C4(C=C(C(=O)C5(C)C)C#N)C)C)C)C(=O)OC)CInChIKey: WPTTVJLTNAWYAO-KPOXMGGZSA-NInChI: show moreSynonyms: Bardoxolone methyl [USAN] | AKOS025401880 | Oleana-1,9(11)-dien-28-oic acid, 2-cyano-3,12-dioxo-, methyl ester | CAS-...
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Rosolic acidFormula: C19H14O3 Molecular Weight: 290.31IUPAC Name: 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-oneSMILES: C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)OInChIKey: FYEHYMARPSSOBO-UHFFFAOYSA-NInChI: InChI=1S/C19H14O3/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,20-21HSynonyms: Aurin | p-Rosolic Acid
