Compound Details

 Compound-ID 27212
 Common Name CENTA
 InChI InChI=1S/C21H17N3O8S3/c25-15(7-11-2-1-5-33-11)22-16-18(26)23-17(21(29)30)10(9-35-19(16)23)8-34-12-3-4-14(24(31)32)13(6-12)20(27)28/h1-6,16,19H,7-9H2,(H,22,25)(H,27,28)(H,29,30)/t16-,19-/m1/s1
 SMILES c1cc(sc1)CC(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSc4ccc(c(c4)C(=O)O)[N+](=O)[O-])C(=O)O
 External Links
 PUBCHEM-CID 133358
 CHEMSPIDER-ID 117649
 METANETX-ID MNXM167405


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