小分子和化合物库
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芹菜素分子式: C15H10O5 分子量: 270.24IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-oneSMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OInChIKey: KZNIFHPLKGYRTM-UHFFFAOYSA-NInChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
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溴匹立明CAS号 : 56741-95-8 Compound CID : 135413497分子式: C10H8BrN3O 分子量: 266.09IUPAC Name: 2-amino-5-bromo-4-phenyl-1H-pyrimidin-6-oneSMILES: C1=CC=C(C=C1)C2=C(C(=O)NC(=N2)N)BrInChIKey: CIUUIPMOFZIWIZ-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15)
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木犀草素CAS号 : 491-70-3(DMSO)分子式: C15H10O6 分子量: 286.24SMILES: OC1=CC(=C2C(=O)C=C(OC2=C1)C3=CC=C(O)C(=C3)O)O
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芹菜素CAS号 : 520-36-5(DMSO)分子式: C15H10O5 分子量: 270.24SMILES: OC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(O)C=C3O
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非布索坦CAS号 : 144060-53-7(DMSO)分子式: C16H16N2O3S 分子量: 316.37SMILES: CC(C)COC1=C(C=C(C=C1)C2=NC(=C(S2)C(O)=O)C)C#N
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9-PhenylguanineCAS号 : 14443-33-5 Compound CID : 135415592分子式: C11H9N5O 分子量: 227.22IUPAC Name: 2-amino-9-phenyl-1H-purin-6-oneSMILES: C1=CC=C(C=C1)N2C=NC3=C2N=C(NC3=O)NInChIKey: XOVSLVYAFGLDMS-UHFFFAOYSA-NInChI: InChI=1S/C11H9N5O/c12-11-14-9-8(10(17)15-11)13-6-16(9)7-4-2-1-3-5-7/h1-6H,(H3,12,14,15,17)
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4(1H)-Pyrimidinone, 2-amino-5-chloro-6-phenyl-CAS号 : 72962-09-5 Compound CID : 135480622分子式: C10H8ClN3O 分子量: 221.64IUPAC Name: 2-amino-5-chloro-4-phenyl-1H-pyrimidin-6-oneSMILES: C1=CC=C(C=C1)C2=C(C(=O)NC(=N2)N)ClInChIKey: VOSRRSSOXKZTFS-UHFFFAOYSA-NInChI: InChI=1S/C10H8ClN3O/c11-7-8(6-4-2-1-3-5-6)13-10(12)14-9(7)15/h1-5H,(H3,12,13,14,15)
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芹菜素分子式: C15H10O5 分子量: 270.24IUPAC Name: 5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-oneSMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OInChIKey: KZNIFHPLKGYRTM-UHFFFAOYSA-NInChI: InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
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槲皮素CAS号 : 117-39-5分子式: C15H10O7 分子量: 302.24IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-oneSMILES: C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)OInChIKey: REFJWTPEDVJJIY-UHFFFAOYSA-NInChI: InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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