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Molecular weight: 684.69
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Iso. SMILES:
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CCO/N=C(/C1=NSC(=N1)NP(=O)(O)O)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)SC4=NC(=CS4)C5=CC=[N+](C=C5)C)C(=O)[O-]
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InChI Key:
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ZCCUWMICIWSJIX-NQJJCJBVSA-N
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Can. SMILES:
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CCO/N=C(/C1=NSC(=N1)NP(=O)(O)O)\C(=O)N[C@@H]2C(=O)N3C(=C(CS[C@H]23)SC4=NC(=CS4)C5=CC=[N+](C)C=C5)C(=O)[O-]
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InChI:
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InChI=1S/C22H21N8O8PS4/c1-3-38-26-13(16-25-21(43-28-16)27-39(35,36)37)17(31)24-14-18(32)30-15(20(33)34)12(9-40-19(14)30)42-22-23-11(8-41-22)10-4-6-29(2)7-5-10/h4-8,14,19H,3,9H2,1-2H3,(H4-,24,25,27,28,31,33,34,35,36,37)/b26-13-/t14-,19-/m1/s1
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