Basic Information |
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| Product Name: | TUNICAMYCIN A1 HOMOLOG |
| CAS: | 66081-37-6 |
| English Synonyms: | TUNICAMYCIN A1 HOMOLOG |
| MDL Number.: | MFCD00058591 |
| H bond acceptor: | 20 |
| H bond donor: | 11 |
| Smile: | CC(C)CCCCCCCC/C=C/C(=O)N[C@H]1[C@@H]([C@@H]([C@@H](O[C@@H]1O[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)NC(=O)C)CC([C@@H]3[C@H]([C@H]([C@@H](O3)n4ccc(=O)[nH]c4=O)O)O)O)O)O |
| InChi: | InChI=1S/C37H60N4O16/c1-18(2)12-10-8-6-4-5-7-9-11-13-23(45)39-26-30(50)27(47)21(54-36(26)57-35-25(38-19(3)43)29(49)28(48)22(17-42)55-35)16-20(44)33-31(51)32(52)34(56-33)41-15-14-24(46)40-37(41)53/h11,13-15,18,20-22,25-36,42,44,47-52H,4-10,12,16-17H2,1-3H3,(H,38,43)(H,39,45)(H,40,46,53)/b13-11+/t20?,21-,22-,25-,26-,27+,28-,29-,30-,31-,32+,33+,34+,35+,36+/m0/s1 |
| InChiKey: | InChIKey=YJQCOFNZVFGCAF-MYGKCLSCSA-N |
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