氨苄青霉素(7177-48-2)红外图谱(IR2)
分子式:C16H25N3O7S
分子量: 403.45
InChI: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
InChIKey: RXDALBZNGVATNY-UHFFFAOYSA-N
Smiles:N12C(C(NC(=O)C(N)C3=CC=CC=C3)C1=O)SC(C)(C)C2C(O)=O.[H]O[H].[H]O[H].[H]O[H]