(2R,5R,8S,15S,18S)-methyl 11-(aminomethyl)-15-(methoxycarbonyl)-2,5,18-trimethyl-4,7,12,17,20-pentaoxo-8-(2,2,2-trifluoroacetamido)-21-(4-(trimethylstannyl)phenoxy)-3,6,16,19-tetraazahenicosan-1-oate
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Basic information
| GHS | |
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| Exact Mass | 910.27464 |
| Smiles | C[C@H](C(OC)=O)NC([C@@H](C)NC([C@H](CCC(C(CC[C@@H](C(OC)=O)NC([C@H](C)NC(COC1=CC=C([Sn](C)(C)C)C=C1)=O)=O)=O)CN)NC(C(F)(F)F)=O)=O)=O |
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| Canonical Smiles | C[C@@H](NC(=O)[C@H](CCC(CN)C(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)COC1C=CC(=CC=1)[Sn](C)(C)C)C(=O)OC)NC(=O)C(F)(F)F)C(=O)N[C@H](C)C(=O)OC |
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| Inchi | InChI=1S/C32H44F3N6O11.3CH3.Sn/c1-17(37-25(43)16-52-21-9-7-6-8-10-21)27(45)40-23(30(48)51-5)13-14-24(42)20(15-36)11-12-22(41-31(49)32(33,34)35)28(46)38-18(2)26(44)39-19(3)29(47)50-4;;;;/h7-10,17-20,22-23H,11-16,36H2,1-5H3,(H,37,43)(H,38,46)(H,39,44)(H,40,45)(H,41,49);3*1H3;/t17-,18+,19+,20?,22-,23-;;;;/m0..../s1 |
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| InchiKey | FGYVVVDVJUAURW-JUTVHUDTSA-N |
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