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SMILES: N1C(=O)N[C@H]2CS[C@@H](CCCCC(=O)NCCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)(O)O)N)O)[C@@H]12 Canonical SMILES: O=C(NCCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)(O)O)N)O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2 InChI: InChI=1S/C28H53N4O7PS/c29-22(20-39-40(36,37)38)24(33)16-12-10-8-6-4-2-1-3-5-7-9-11-15-19-30-26(34)18-14-13-17-25-27-23(21-41-25)31-28(35)32-27/h12,16,22-25,27,33H,1-11,13-15,17-21,29H2,(H,30,34)(H2,31,32,35)(H2,36,37,38)/b16-12+/t22-,23-,24+,25-,27-/m0/s1 InChIKey: JHROEHVYJZWKKP-RPRIXWAOSA-N
CBID:160481 http://www.chembase.cn/molecule-160481.html