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拉莫三嗪-¹³C₃CAS号 : 1188265-38-4 Compound CID : 45039644分子式: C613C3H7Cl2N5 分子量: 259.07IUPAC Name: 6-(2,3-dichlorophenyl)-(3,5,6-13C3)1,2,4-triazine-3,5-diamineSMILES: N[13c]1nn[13c]([13c](N)n1)c2cccc(Cl)c2ClInChIKey: PYZRQGJRPPTADH-ULEDQSHZSA-NInChI: InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)/i7+1,8+1,9+1
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4-吡哆酸-d3CAS号 : 1435934-03-4 Compound CID : 117064439分子式: C8H6D3NO4 分子量: 186.18IUPAC Name: 3-hydroxy-5-(hydroxymethyl)-2-(trideuteriomethyl)pyridine-4-carboxylic acidSMILES: CC1=NC=C(C(=C1O)C(=O)O)COInChIKey: HXACOUQIXZGNBF-FIBGUPNXSA-NInChI: InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13)/i1D3
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氨苄西林 三水合物分子式: C16H19N3O4S·3H2O 分子量: 403.45IUPAC Name: (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;trihydrateSMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C.O.O.OInChIKey: RXDALBZNGVATNY-CWLIKTDRSA-NInChI: InChI=1S/C16H19N3O4S.3H2O/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;;;/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);3*1H2/t9-,10-,11+,14-;;;/m1.../s1
