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MMP
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3-延胡素酸氨基丙腈酯分子式: (C3H6N2)2·C4H4O4 分子量: 256.26IUPAC Name: 3-aminopropanenitrile;(E)-but-2-enedioic acidSMILES: C(CN)C#N.C(CN)C#N.C(=CC(=O)O)C(=O)OInChIKey: NYMXYZMHOZAPHQ-SEPHDYHBSA-NInChI: 1S/C4H4O4.2C3H6N2/c5-3(6)1-2-4(7)8;2*4-2-1-3-5/h1-2H,(H,5,6)(H,7,8);2*1-2,4H2/b2-1+;;
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氨甲环酸 (AMCA)CAS号: 1197-18-8分子式: C8H15NO2 分子量: 157.21IUPAC Name: 4-(aminomethyl)cyclohexane-1-carboxylic acidSMILES: NC[C@H]1CC[C@@H](CC1)C(O)=OInChIKey: GYDJEQRTZSCIOI-UHFFFAOYSA-NInChI: 1S/C8H15NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h6-7H,1-5,9H2,(H,10,11)
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脱水淫羊藿素CAS号: 38226-86-7分子式: C21H20O6 分子量: 368.38IUPAC Name: 3,5-dihydroxy-2-(4-methoxyphenyl)-8,8-dimethyl-9,10-dihydropyrano[2,3-h]chromen-4-oneSMILES: CC1(CCC2=C(O1)C=C(C3=C2OC(=C(C3=O)O)C4=CC=C(C=C4)OC)O)CInChIKey: PPCHTBBOSVKORE-UHFFFAOYSA-NInChI: 1S/C21H20O6/c1-21(2)9-8-13-15(27-21)10-14(22)16-17(23)18(24)19(26-20(13)16)11-4-6-12(25-3)7-5-11/h4-7,10,22,24H,8-9H2,1-3H3
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牛蒡子苷元CAS号: 7770-78-7分子式: C21H24O6 分子量: 372.41IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-oneSMILES: COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)OCInChIKey: NQWVSMVXKMHKTF-JKSUJKDBSA-NInChI: 1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1
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牛蒡子苷元CAS号: 7770-78-7分子式: C21H24O6 分子量: 372.41IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-oneSMILES: COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)OCInChIKey: NQWVSMVXKMHKTF-JKSUJKDBSA-NInChI: 1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1
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美洛昔康CAS号: 71125-38-7分子式: C14H13N3O4S2 分子量: 351.4IUPAC Name: 4-hydroxy-2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamideSMILES: CC1=CN=C(S1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)OInChIKey: ZRVUJXDFFKFLMG-UHFFFAOYSA-NInChI: 1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,18H,1-2H3,(H,15,16,19)
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NSC 405020,非催化MT1-MMP抑制剂CAS号: 7497-07-6分子式: C12H15Cl2NO 分子量: 260.16IUPAC Name: 3,4-dichloro-N-pentan-2-ylbenzamideSMILES: CCCC(C)NC(=O)C1=CC(=C(C=C1)Cl)ClInChIKey: ARDYECYBETXQFD-UHFFFAOYSA-NInChI: 1S/C12H15Cl2NO/c1-3-4-8(2)15-12(16)9-5-6-10(13)11(14)7-9/h5-8H,3-4H2,1-2H3,(H,15,16)
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