Basic Information |
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Product Name: | RIFAMYCIN S |
CAS: | 13553-79-2 |
English Synonyms: | RIFAMYCIN S ; 1,4-DIDEOXY-1,4-DIHYDRO-1,4-DIOXO-RIFAMYCIN ; RIFAMPICIN S |
MDL Number.: | MFCD06198807 |
H bond acceptor: | 13 |
H bond donor: | 4 |
Smile: | Cc1c(c2c3c4c1O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(\C(=O)NC(=CC3=O)C2=O)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O |
InChi: | InChI=1S/C37H45NO12/c1-16-11-10-12-17(2)36(46)38-23-15-24(40)26-27(32(23)44)31(43)21(6)34-28(26)35(45)37(8,50-34)48-14-13-25(47-9)18(3)33(49-22(7)39)20(5)30(42)19(4)29(16)41/h10-16,18-20,25,29-30,33,41-43H,1-9H3,(H,38,46)/b11-10+,14-13+,17-12-/t16-,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1 |
InChiKey: | InChIKey=BTVYFIMKUHNOBZ-ODRIEIDWSA-N |
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