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4-[2-(4-氨基苯基)乙炔基]苯胺分子式: C14H12N2 分子量: 208.26IUPAC Name: 4-[2-(4-aminophenyl)ethynyl]anilineSMILES: C1=CC(=CC=C1C#CC2=CC=C(C=C2)N)NInChIKey: WAUKJWLKPXRNKT-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,15-16H2
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甲氧基X04CAS号 : 863918-78-9 Compound CID : 16049314分子式: C23H20O3 分子量: 344.4IUPAC Name: 4-[(E)-2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]-3-methoxyphenyl]ethenyl]phenolSMILES: COC1=C(C=CC(=C1)C=CC2=CC=C(C=C2)O)C=CC3=CC=C(C=C3)OInChIKey: FGYNZFHVGOFCMD-KHVHPYDTSA-NInChI: InChI=1S/C23H20O3/c1-26-23-16-19(3-2-17-6-12-21(24)13-7-17)5-11-20(23)10-4-18-8-14-22(25)15-9-18/h2-16,24-25H,1H3/b3-2+,10-4+
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姜黄素CAS号 : 458-37-7(DMSO)分子式: C21H20O6 分子量: 368.38SMILES: COC1=CC(=CC=C1O)/C=C/C(O)=C/C(=O)/C=C/C2=CC(=C(O)C=C2)OC
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维生素A酸CAS号 : 302-79-4(DMSO)分子式: C20H28O2 分子量: 300.4SMILES: CC1=C(\C=C\C(C)=C\C=C\C(C)=C\C(O)=O)C(C)(C)CCC1
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（-）-表没食子儿茶素没食子酸酯CAS号 : 989-51-5(DMSO)分子式: C22H18O11 分子量: 458.37SMILES: OC1=CC2=C(CC(OC(=O)C3=CC(=C(O)C(=C3)O)O)C(O2)C4=CC(=C(O)C(=C4)O)O)C(=C1)O
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异绿原酸CCAS号 : 57378-72-0 Compound CID : 6474309分子式: C25H24O12 分子量: 516.45IUPAC Name: (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acidSMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)OInChIKey: UFCLZKMFXSILNL-RVXRWRFUSA-NInChI: InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
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二咖啡酰奎宁酸CAS号 : 57378-72-0 Compound CID : 6474309分子式: C25H24O12 分子量: 516.45IUPAC Name: (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acidSMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)OInChIKey: UFCLZKMFXSILNL-RVXRWRFUSA-NInChI: InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
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PiBCAS号 : 566169-93-5 Compound CID : 10171487分子式: C14H12N2OS 分子量: 256.32IUPAC Name: 2-[4-(methylamino)phenyl]-1,3-benzothiazol-6-olSMILES: CNC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)OInChIKey: ZQAQXZBSGZUUNL-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2OS/c1-15-10-4-2-9(3-5-10)14-16-12-7-6-11(17)8-13(12)18-14/h2-8,15,17H,1H3
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2-(4-Aminophenyl)benzo[d]thiazol-6-olCAS号 : 178804-18-7 Compound CID : 10444413分子式: C13H10N2OS 分子量: 242.3IUPAC Name: 2-(4-aminophenyl)-1,3-benzothiazol-6-olSMILES: C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)O)NInChIKey: KYQOWAHXMWGEJG-UHFFFAOYSA-NInChI: InChI=1S/C13H10N2OS/c14-9-3-1-8(2-4-9)13-15-11-6-5-10(16)7-12(11)17-13/h1-7,16H,14H2
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4-[(E)-2-(4-Aminophenyl)ethenyl]phenol分子式: C14H13NO 分子量: 211.26IUPAC Name: 4-[(E)-2-(4-aminophenyl)ethenyl]phenolSMILES: C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)NInChIKey: HGDVTCNLNRCTHW-OWOJBTEDSA-NInChI: InChI=1S/C14H13NO/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h1-10,16H,15H2/b2-1+
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4-[Benzo(b)thiophen-2-yl]phenolCAS号 : 65540-08-1 Compound CID : 10220170分子式: C14H10OS 分子量: 226.3IUPAC Name: 4-(1-benzothiophen-2-yl)phenolSMILES: C1=CC=C2C(=C1)C=C(S2)C3=CC=C(C=C3)OInChIKey: BTHAMNJTBJFIQX-UHFFFAOYSA-NInChI: InChI=1S/C14H10OS/c15-12-7-5-10(6-8-12)14-9-11-3-1-2-4-13(11)16-14/h1-9,15H
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(1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-oneCompound CID : 5281767分子式: C21H20O6 分子量: 368.4IUPAC Name: (1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-oneSMILES: COC1=C(C=CC(=C1)C=CC(=CC(=O)C=CC2=CC(=C(C=C2)O)OC)O)OInChIKey: ZIUSSTSXXLLKKK-KOBPDPAPSA-NInChI: InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-13,22,24-25H,1-2H3/b7-3+,8-4+,16-13-
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