Basic Information |
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Product Name: | ZAURATEGRAST |
CAS: | 455264-31-0 |
English Synonyms: | CDP 323 ; ZAURATEGRAST ; (S)-3-(4-((2,7-NAPHTHYRIDIN-1-YL)AMINO)PHENYL)-2-((2-BROMO-3-OXOSPIRO[3.5]NON-1-EN-1-YL)AMINO)PROPANOIC ACID ; N-(2-BROMO-3-OXOSPIRO[3.5]NON-1-EN-1-YL)-4-(2,7-NAPHTHYRIDIN-1-YLAMINO)-L-PHENYLALANINE |
MDL Number.: | MFCD16657118 |
H bond acceptor: | 7 |
H bond donor: | 3 |
Smile: | c1cc(ccc1C[C@@H](C(=O)O)NC2=C(C(=O)C23CCCCC3)Br)Nc4c5cnccc5ccn4 |
InChi: | InChI=1S/C26H25BrN4O3/c27-21-22(26(23(21)32)10-2-1-3-11-26)31-20(25(33)34)14-16-4-6-18(7-5-16)30-24-19-15-28-12-8-17(19)9-13-29-24/h4-9,12-13,15,20,31H,1-3,10-11,14H2,(H,29,30)(H,33,34)/t20-/m0/s1 |
InChiKey: | InChIKey=KYHVWHYLKOHLKA-FQEVSTJZSA-N |
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