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CAS No.	英文名/中文名/SMILES	分子式	分子量
1174657-07-8	Cilastatin ep impurity E Cilastatin Sodium Impurity E(EP) C(CCC(=O)C(=O)O)CCSCC(C(=O)O)N	C₁₀H₁₇NO₅S	263.31
887256-40-8	5-Amino-2-hydroxy-4'-sulfo-[1,1'-biphenyl]-3-carboxylic acid - C1=CC(=CC=C1C2=C(C(=CC(=C2)N)C(=O)O)O)S(=O)(=O)O	C₁₃H₁₁NO₆S	309.30
3625-06-7	Mebeverine 美贝维林 CCN(CCCCOC(=O)C1=CC(=C(C=C1)OC)OC)C(C)CC2=CC=C(C=C2)OC	C₂₅H₃₅NO₅	429.5
121-25-5	1-((4-Amino-2-propyl-5-pyrimidinyl)methyl)-2-picolinium chloride 安普罗林 CCCC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2C.[Cl-]	C₁₄H₁₉ClN₄	278.78
5053-06-5	Fenspiride 芬司匹利 C1CN(CCC12CNC(=O)O2)CCC3=CC=CC=C3	C₁₅H₂₀N₂O₂	260.33
1572583-29-9	Teneligliptin hydrobromide hydrate [(2S,4S)-4-[4-(3-甲基-1-苯基-1H-吡唑-5-基)-1-哌嗪基]-2-吡咯烷基]-3-噻唑烷基甲酮氢溴酸盐水合物(2:5:) CC1=NN(C(=C1)N2CCN(CC2)C3CC(NC3)C(=O)N4CCSC4)C5=CC=CC=C5.CC1=NN(C(=C1)N2CCN(CC2)C3CC(NC3)C(=O)N4CCSC4)C5=CC=CC=C5.O.Br.Br.Br.Br.Br	C₄₄H₆₇BR₅N₁₂O₃S₂	1275.7
7091-05-6	9beta,11beta-Epoxy-17,21-dihydroxypregna-1,4-diene-3,20-dione 泼尼松龙环氧 CC12CC3C4(O3)C(C1CCC2(C(=O)CO)O)CCC5=CC(=O)C=CC45C	C₂₁H₂₆O₅	358.4
2214-72-4	1,3-Bis(2-chloroethyl)urea 1,3-Bis(2-chloroethyl)urea C(CCl)NC(=O)NCCCl	C₅H₁₀Cl₂N₂O	185.05
81110-69-2	Benzyl 2-(2-benzyl-3-mercaptopropanamido)acetate Deacetyl Racecadotril C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)OCC2=CC=CC=C2	C₁₉H₂₁NO₃S	343.4
84957-29-9	Cefpirome 头孢匹罗 CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC5=C4CCC5)C(=O)[O-]	C₂₂H₂₂N₆O₅S₂	514.6